USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 920 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 54 GLN : amide:sc= -2.77 K(o=-2.8,f=-3.5!) USER MOD Set 1.2: A 60 SER OG : rot -140:sc= 0 USER MOD Set 2.1: A 27 TYR OH : rot 30:sc= 0.0124 USER MOD Set 2.2: A 120 SER OG : rot 176:sc= 0.0149 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 129:sc= 1.38 USER MOD Single : A 11 SER OG : rot 180:sc= 0.149 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl -107:sc= -0.155 (180deg=-1.51) USER MOD Single : A 19 HIS : no HD1:sc= -1.35 K(o=-1.4,f=-0.12) USER MOD Single : A 21 THR OG1 : rot 59:sc= -0.281 USER MOD Single : A 24 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.024) USER MOD Single : A 30 THR OG1 : rot 180:sc=-0.00518 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 160:sc= -0.195 USER MOD Single : A 55 ASN : amide:sc= -0.0295 X(o=-0.03,f=-0.036) USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -1.06 X(o=-1.1,f=-1.2) USER MOD Single : A 72 SER OG : rot -50:sc= 0.276 USER MOD Single : A 74 TYR OH : rot 156:sc= 0.696 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.287 USER MOD Single : A 83 THR OG1 : rot 110:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 87 SER OG : rot 180:sc= 0.142 USER MOD Single : A 91 LYS NZ :NH3+ 176:sc=-0.00805 (180deg=-0.0295) USER MOD Single : A 100 THR OG1 : rot -130:sc= 0.0531 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.365 X(o=-0.36,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.191 0.060 -0.735 1.00 53.14 N ATOM 2 CA MET A 1 2.208 0.944 -1.293 1.00 30.20 C ATOM 3 C MET A 1 3.608 0.420 -0.991 1.00 23.31 C ATOM 4 O MET A 1 4.014 0.341 0.169 1.00 64.41 O ATOM 5 CB MET A 1 2.048 2.358 -0.732 1.00 43.22 C ATOM 6 CG MET A 1 3.129 3.321 -1.195 1.00 43.34 C ATOM 7 SD MET A 1 2.834 5.013 -0.646 1.00 3.11 S ATOM 8 CE MET A 1 3.824 5.062 0.846 1.00 31.32 C ATOM 0 H1 MET A 1 0.246 0.437 -0.953 1.00 53.14 H new ATOM 0 H2 MET A 1 1.290 -0.888 -1.150 1.00 53.14 H new ATOM 0 H3 MET A 1 1.311 0.001 0.296 1.00 53.14 H new ATOM 0 HA MET A 1 2.075 0.973 -2.375 1.00 30.20 H new ATOM 0 HB2 MET A 1 1.074 2.749 -1.027 1.00 43.22 H new ATOM 0 HB3 MET A 1 2.057 2.311 0.357 1.00 43.22 H new ATOM 0 HG2 MET A 1 4.095 2.984 -0.819 1.00 43.34 H new ATOM 0 HG3 MET A 1 3.186 3.301 -2.283 1.00 43.34 H new ATOM 0 HE1 MET A 1 3.745 6.048 1.303 1.00 31.32 H new ATOM 0 HE2 MET A 1 3.465 4.308 1.546 1.00 31.32 H new ATOM 0 HE3 MET A 1 4.866 4.860 0.598 1.00 31.32 H new ATOM 18 N ILE A 2 4.341 0.063 -2.040 1.00 72.15 N ATOM 19 CA ILE A 2 5.695 -0.453 -1.886 1.00 44.33 C ATOM 20 C ILE A 2 6.592 0.559 -1.180 1.00 53.03 C ATOM 21 O ILE A 2 6.879 1.629 -1.716 1.00 42.35 O ATOM 22 CB ILE A 2 6.319 -0.812 -3.248 1.00 23.33 C ATOM 23 CG1 ILE A 2 5.465 -1.860 -3.964 1.00 52.01 C ATOM 24 CG2 ILE A 2 7.742 -1.319 -3.061 1.00 52.42 C ATOM 25 CD1 ILE A 2 5.402 -3.187 -3.240 1.00 44.41 C ATOM 0 H ILE A 2 4.020 0.122 -3.006 1.00 72.15 H new ATOM 0 HA ILE A 2 5.622 -1.356 -1.280 1.00 44.33 H new ATOM 0 HB ILE A 2 6.352 0.086 -3.865 1.00 23.33 H new ATOM 0 HG12 ILE A 2 4.453 -1.472 -4.083 1.00 52.01 H new ATOM 0 HG13 ILE A 2 5.865 -2.020 -4.965 1.00 52.01 H new ATOM 0 HG21 ILE A 2 8.170 -1.569 -4.032 1.00 52.42 H new ATOM 0 HG22 ILE A 2 8.345 -0.544 -2.587 1.00 52.42 H new ATOM 0 HG23 ILE A 2 7.732 -2.208 -2.430 1.00 52.42 H new ATOM 0 HD11 ILE A 2 4.780 -3.881 -3.805 1.00 44.41 H new ATOM 0 HD12 ILE A 2 6.407 -3.597 -3.144 1.00 44.41 H new ATOM 0 HD13 ILE A 2 4.974 -3.041 -2.248 1.00 44.41 H new ATOM 37 N ARG A 3 7.032 0.212 0.025 1.00 74.02 N ATOM 38 CA ARG A 3 7.896 1.090 0.804 1.00 22.55 C ATOM 39 C ARG A 3 9.366 0.819 0.496 1.00 31.43 C ATOM 40 O ARG A 3 10.155 1.746 0.313 1.00 0.25 O ATOM 41 CB ARG A 3 7.635 0.901 2.300 1.00 55.31 C ATOM 42 CG ARG A 3 8.142 2.050 3.156 1.00 22.23 C ATOM 43 CD ARG A 3 7.382 3.336 2.871 1.00 22.42 C ATOM 44 NE ARG A 3 7.557 4.322 3.934 1.00 32.21 N ATOM 45 CZ ARG A 3 8.665 5.035 4.100 1.00 23.45 C ATOM 46 NH1 ARG A 3 9.692 4.872 3.277 1.00 31.34 N ATOM 47 NH2 ARG A 3 8.748 5.913 5.092 1.00 42.05 N ATOM 0 H ARG A 3 6.804 -0.671 0.483 1.00 74.02 H new ATOM 0 HA ARG A 3 7.668 2.120 0.529 1.00 22.55 H new ATOM 0 HB2 ARG A 3 6.563 0.784 2.461 1.00 55.31 H new ATOM 0 HB3 ARG A 3 8.110 -0.023 2.629 1.00 55.31 H new ATOM 0 HG2 ARG A 3 8.040 1.792 4.210 1.00 22.23 H new ATOM 0 HG3 ARG A 3 9.204 2.205 2.967 1.00 22.23 H new ATOM 0 HD2 ARG A 3 7.724 3.757 1.926 1.00 22.42 H new ATOM 0 HD3 ARG A 3 6.322 3.112 2.755 1.00 22.42 H new ATOM 0 HE ARG A 3 6.786 4.471 4.585 1.00 32.21 H new ATOM 0 HH11 ARG A 3 9.632 4.198 2.514 1.00 31.34 H new ATOM 0 HH12 ARG A 3 10.542 5.421 3.407 1.00 31.34 H new ATOM 0 HH21 ARG A 3 7.960 6.040 5.727 1.00 42.05 H new ATOM 0 HH22 ARG A 3 9.599 6.460 5.219 1.00 42.05 H new ATOM 61 N THR A 4 9.728 -0.460 0.440 1.00 12.55 N ATOM 62 CA THR A 4 11.102 -0.853 0.156 1.00 30.14 C ATOM 63 C THR A 4 11.155 -2.221 -0.514 1.00 33.34 C ATOM 64 O THR A 4 10.137 -2.904 -0.632 1.00 70.21 O ATOM 65 CB THR A 4 11.953 -0.890 1.440 1.00 14.51 C ATOM 66 OG1 THR A 4 11.283 -1.652 2.450 1.00 14.44 O ATOM 67 CG2 THR A 4 12.219 0.518 1.953 1.00 64.34 C ATOM 0 H THR A 4 9.088 -1.240 0.588 1.00 12.55 H new ATOM 0 HA THR A 4 11.511 -0.103 -0.521 1.00 30.14 H new ATOM 0 HB THR A 4 12.907 -1.361 1.204 1.00 14.51 H new ATOM 0 HG1 THR A 4 11.895 -2.327 2.810 1.00 14.44 H new ATOM 0 HG21 THR A 4 12.821 0.467 2.860 1.00 64.34 H new ATOM 0 HG22 THR A 4 12.755 1.087 1.193 1.00 64.34 H new ATOM 0 HG23 THR A 4 11.272 1.010 2.174 1.00 64.34 H new ATOM 75 N ILE A 5 12.346 -2.616 -0.949 1.00 43.13 N ATOM 76 CA ILE A 5 12.531 -3.904 -1.606 1.00 31.11 C ATOM 77 C ILE A 5 13.862 -4.536 -1.212 1.00 73.03 C ATOM 78 O ILE A 5 14.840 -3.836 -0.947 1.00 52.22 O ATOM 79 CB ILE A 5 12.473 -3.768 -3.139 1.00 24.01 C ATOM 80 CG1 ILE A 5 11.193 -3.045 -3.561 1.00 11.31 C ATOM 81 CG2 ILE A 5 12.555 -5.138 -3.796 1.00 5.14 C ATOM 82 CD1 ILE A 5 11.145 -2.712 -5.036 1.00 32.13 C ATOM 0 H ILE A 5 13.198 -2.063 -0.858 1.00 43.13 H new ATOM 0 HA ILE A 5 11.715 -4.547 -1.276 1.00 31.11 H new ATOM 0 HB ILE A 5 13.327 -3.177 -3.469 1.00 24.01 H new ATOM 0 HG12 ILE A 5 10.334 -3.667 -3.309 1.00 11.31 H new ATOM 0 HG13 ILE A 5 11.099 -2.124 -2.986 1.00 11.31 H new ATOM 0 HG21 ILE A 5 12.513 -5.025 -4.879 1.00 5.14 H new ATOM 0 HG22 ILE A 5 13.492 -5.619 -3.518 1.00 5.14 H new ATOM 0 HG23 ILE A 5 11.719 -5.752 -3.462 1.00 5.14 H new ATOM 0 HD11 ILE A 5 10.210 -2.201 -5.263 1.00 32.13 H new ATOM 0 HD12 ILE A 5 11.984 -2.064 -5.290 1.00 32.13 H new ATOM 0 HD13 ILE A 5 11.207 -3.631 -5.619 1.00 32.13 H new ATOM 94 N LEU A 6 13.893 -5.864 -1.178 1.00 15.42 N ATOM 95 CA LEU A 6 15.105 -6.592 -0.818 1.00 55.35 C ATOM 96 C LEU A 6 15.421 -7.667 -1.853 1.00 40.44 C ATOM 97 O LEU A 6 14.630 -8.583 -2.073 1.00 32.23 O ATOM 98 CB LEU A 6 14.950 -7.228 0.564 1.00 71.32 C ATOM 99 CG LEU A 6 15.936 -8.346 0.902 1.00 25.50 C ATOM 100 CD1 LEU A 6 17.369 -7.865 0.731 1.00 53.53 C ATOM 101 CD2 LEU A 6 15.707 -8.849 2.320 1.00 60.42 C ATOM 0 H LEU A 6 13.093 -6.458 -1.395 1.00 15.42 H new ATOM 0 HA LEU A 6 15.932 -5.883 -0.793 1.00 55.35 H new ATOM 0 HB2 LEU A 6 15.048 -6.445 1.316 1.00 71.32 H new ATOM 0 HB3 LEU A 6 13.938 -7.625 0.648 1.00 71.32 H new ATOM 0 HG LEU A 6 15.767 -9.173 0.212 1.00 25.50 H new ATOM 0 HD11 LEU A 6 18.056 -8.675 0.976 1.00 53.53 H new ATOM 0 HD12 LEU A 6 17.528 -7.554 -0.302 1.00 53.53 H new ATOM 0 HD13 LEU A 6 17.551 -7.021 1.396 1.00 53.53 H new ATOM 0 HD21 LEU A 6 16.418 -9.645 2.543 1.00 60.42 H new ATOM 0 HD22 LEU A 6 15.847 -8.029 3.024 1.00 60.42 H new ATOM 0 HD23 LEU A 6 14.691 -9.234 2.410 1.00 60.42 H new ATOM 113 N ALA A 7 16.584 -7.548 -2.485 1.00 62.22 N ATOM 114 CA ALA A 7 17.007 -8.512 -3.494 1.00 4.23 C ATOM 115 C ALA A 7 18.399 -9.053 -3.186 1.00 45.21 C ATOM 116 O ALA A 7 19.381 -8.310 -3.201 1.00 44.10 O ATOM 117 CB ALA A 7 16.980 -7.876 -4.876 1.00 34.03 C ATOM 0 H ALA A 7 17.250 -6.794 -2.316 1.00 62.22 H new ATOM 0 HA ALA A 7 16.308 -9.348 -3.477 1.00 4.23 H new ATOM 0 HB1 ALA A 7 17.298 -8.607 -5.619 1.00 34.03 H new ATOM 0 HB2 ALA A 7 15.967 -7.544 -5.104 1.00 34.03 H new ATOM 0 HB3 ALA A 7 17.655 -7.021 -4.896 1.00 34.03 H new ATOM 123 N ILE A 8 18.477 -10.350 -2.907 1.00 51.40 N ATOM 124 CA ILE A 8 19.749 -10.989 -2.596 1.00 43.03 C ATOM 125 C ILE A 8 20.196 -11.905 -3.731 1.00 34.24 C ATOM 126 O ILE A 8 19.404 -12.685 -4.260 1.00 71.14 O ATOM 127 CB ILE A 8 19.665 -11.807 -1.294 1.00 3.42 C ATOM 128 CG1 ILE A 8 19.063 -10.959 -0.172 1.00 12.33 C ATOM 129 CG2 ILE A 8 21.043 -12.316 -0.899 1.00 22.24 C ATOM 130 CD1 ILE A 8 17.595 -11.231 0.070 1.00 74.22 C ATOM 0 H ILE A 8 17.674 -10.979 -2.890 1.00 51.40 H new ATOM 0 HA ILE A 8 20.480 -10.191 -2.467 1.00 43.03 H new ATOM 0 HB ILE A 8 19.016 -12.666 -1.463 1.00 3.42 H new ATOM 0 HG12 ILE A 8 19.615 -11.145 0.749 1.00 12.33 H new ATOM 0 HG13 ILE A 8 19.194 -9.904 -0.415 1.00 12.33 H new ATOM 0 HG21 ILE A 8 20.967 -12.892 0.023 1.00 22.24 H new ATOM 0 HG22 ILE A 8 21.438 -12.951 -1.692 1.00 22.24 H new ATOM 0 HG23 ILE A 8 21.713 -11.470 -0.744 1.00 22.24 H new ATOM 0 HD11 ILE A 8 17.236 -10.595 0.879 1.00 74.22 H new ATOM 0 HD12 ILE A 8 17.031 -11.018 -0.838 1.00 74.22 H new ATOM 0 HD13 ILE A 8 17.459 -12.277 0.344 1.00 74.22 H new ATOM 142 N ASP A 9 21.469 -11.807 -4.097 1.00 54.41 N ATOM 143 CA ASP A 9 22.022 -12.629 -5.167 1.00 1.30 C ATOM 144 C ASP A 9 23.536 -12.757 -5.026 1.00 33.11 C ATOM 145 O ASP A 9 24.190 -11.894 -4.441 1.00 10.03 O ATOM 146 CB ASP A 9 21.673 -12.031 -6.531 1.00 4.11 C ATOM 147 CG ASP A 9 20.420 -12.641 -7.127 1.00 13.42 C ATOM 148 OD1 ASP A 9 20.339 -13.885 -7.194 1.00 62.25 O ATOM 149 OD2 ASP A 9 19.519 -11.873 -7.525 1.00 33.24 O ATOM 0 H ASP A 9 22.137 -11.167 -3.669 1.00 54.41 H new ATOM 0 HA ASP A 9 21.582 -13.624 -5.092 1.00 1.30 H new ATOM 0 HB2 ASP A 9 21.536 -10.955 -6.428 1.00 4.11 H new ATOM 0 HB3 ASP A 9 22.508 -12.182 -7.215 1.00 4.11 H new ATOM 154 N ASP A 10 24.085 -13.840 -5.565 1.00 0.11 N ATOM 155 CA ASP A 10 25.522 -14.082 -5.499 1.00 53.33 C ATOM 156 C ASP A 10 26.243 -13.387 -6.651 1.00 33.45 C ATOM 157 O ASP A 10 27.304 -12.792 -6.463 1.00 15.03 O ATOM 158 CB ASP A 10 25.810 -15.583 -5.532 1.00 73.44 C ATOM 159 CG ASP A 10 25.032 -16.345 -4.478 1.00 33.54 C ATOM 160 OD1 ASP A 10 25.631 -16.703 -3.442 1.00 15.52 O ATOM 161 OD2 ASP A 10 23.824 -16.586 -4.688 1.00 42.44 O ATOM 0 H ASP A 10 23.557 -14.564 -6.052 1.00 0.11 H new ATOM 0 HA ASP A 10 25.893 -13.670 -4.560 1.00 53.33 H new ATOM 0 HB2 ASP A 10 25.561 -15.976 -6.518 1.00 73.44 H new ATOM 0 HB3 ASP A 10 26.877 -15.749 -5.382 1.00 73.44 H new ATOM 166 N SER A 11 25.660 -13.469 -7.842 1.00 71.34 N ATOM 167 CA SER A 11 26.249 -12.853 -9.025 1.00 62.13 C ATOM 168 C SER A 11 26.196 -11.331 -8.929 1.00 31.40 C ATOM 169 O SER A 11 25.121 -10.734 -8.961 1.00 14.13 O ATOM 170 CB SER A 11 25.521 -13.321 -10.287 1.00 30.43 C ATOM 171 OG SER A 11 25.692 -12.397 -11.347 1.00 52.00 O ATOM 0 H SER A 11 24.780 -13.956 -8.014 1.00 71.34 H new ATOM 0 HA SER A 11 27.293 -13.160 -9.082 1.00 62.13 H new ATOM 0 HB2 SER A 11 25.899 -14.298 -10.588 1.00 30.43 H new ATOM 0 HB3 SER A 11 24.459 -13.442 -10.074 1.00 30.43 H new ATOM 0 HG SER A 11 25.219 -12.720 -12.142 1.00 52.00 H new ATOM 177 N ALA A 12 27.365 -10.711 -8.811 1.00 2.01 N ATOM 178 CA ALA A 12 27.453 -9.259 -8.712 1.00 22.42 C ATOM 179 C ALA A 12 26.685 -8.584 -9.843 1.00 35.34 C ATOM 180 O ALA A 12 26.082 -7.527 -9.654 1.00 1.13 O ATOM 181 CB ALA A 12 28.909 -8.817 -8.723 1.00 10.01 C ATOM 0 H ALA A 12 28.264 -11.191 -8.782 1.00 2.01 H new ATOM 0 HA ALA A 12 26.999 -8.956 -7.768 1.00 22.42 H new ATOM 0 HB1 ALA A 12 28.960 -7.731 -8.649 1.00 10.01 H new ATOM 0 HB2 ALA A 12 29.431 -9.264 -7.877 1.00 10.01 H new ATOM 0 HB3 ALA A 12 29.380 -9.140 -9.651 1.00 10.01 H new ATOM 187 N THR A 13 26.709 -9.201 -11.020 1.00 24.41 N ATOM 188 CA THR A 13 26.017 -8.659 -12.182 1.00 35.22 C ATOM 189 C THR A 13 24.508 -8.646 -11.965 1.00 53.53 C ATOM 190 O THR A 13 23.834 -7.667 -12.286 1.00 42.30 O ATOM 191 CB THR A 13 26.334 -9.469 -13.453 1.00 50.54 C ATOM 192 OG1 THR A 13 27.744 -9.457 -13.702 1.00 41.12 O ATOM 193 CG2 THR A 13 25.597 -8.898 -14.656 1.00 20.22 C ATOM 0 H THR A 13 27.201 -10.078 -11.194 1.00 24.41 H new ATOM 0 HA THR A 13 26.372 -7.637 -12.314 1.00 35.22 H new ATOM 0 HB THR A 13 26.002 -10.495 -13.296 1.00 50.54 H new ATOM 0 HG1 THR A 13 27.938 -9.975 -14.511 1.00 41.12 H new ATOM 0 HG21 THR A 13 25.836 -9.486 -15.542 1.00 20.22 H new ATOM 0 HG22 THR A 13 24.523 -8.934 -14.475 1.00 20.22 H new ATOM 0 HG23 THR A 13 25.904 -7.864 -14.813 1.00 20.22 H new ATOM 201 N MET A 14 23.983 -9.737 -11.419 1.00 20.51 N ATOM 202 CA MET A 14 22.553 -9.849 -11.158 1.00 34.21 C ATOM 203 C MET A 14 22.130 -8.909 -10.033 1.00 62.40 C ATOM 204 O MET A 14 21.165 -8.158 -10.170 1.00 0.55 O ATOM 205 CB MET A 14 22.189 -11.291 -10.797 1.00 44.12 C ATOM 206 CG MET A 14 20.730 -11.632 -11.052 1.00 1.22 C ATOM 207 SD MET A 14 20.504 -13.321 -11.641 1.00 11.04 S ATOM 208 CE MET A 14 21.350 -14.242 -10.359 1.00 21.42 C ATOM 0 H MET A 14 24.526 -10.557 -11.148 1.00 20.51 H new ATOM 0 HA MET A 14 22.021 -9.564 -12.066 1.00 34.21 H new ATOM 0 HB2 MET A 14 22.818 -11.971 -11.372 1.00 44.12 H new ATOM 0 HB3 MET A 14 22.415 -11.461 -9.744 1.00 44.12 H new ATOM 0 HG2 MET A 14 20.162 -11.493 -10.132 1.00 1.22 H new ATOM 0 HG3 MET A 14 20.322 -10.938 -11.786 1.00 1.22 H new ATOM 0 HE1 MET A 14 22.295 -14.621 -10.747 1.00 21.42 H new ATOM 0 HE2 MET A 14 21.543 -13.588 -9.508 1.00 21.42 H new ATOM 0 HE3 MET A 14 20.727 -15.078 -10.040 1.00 21.42 H new ATOM 218 N ARG A 15 22.859 -8.958 -8.922 1.00 54.05 N ATOM 219 CA ARG A 15 22.558 -8.112 -7.774 1.00 12.11 C ATOM 220 C ARG A 15 22.444 -6.649 -8.191 1.00 43.45 C ATOM 221 O ARG A 15 21.598 -5.912 -7.686 1.00 31.43 O ATOM 222 CB ARG A 15 23.640 -8.265 -6.703 1.00 74.42 C ATOM 223 CG ARG A 15 23.263 -9.231 -5.591 1.00 43.13 C ATOM 224 CD ARG A 15 23.977 -8.890 -4.293 1.00 22.45 C ATOM 225 NE ARG A 15 25.420 -8.761 -4.479 1.00 11.43 N ATOM 226 CZ ARG A 15 26.279 -8.605 -3.478 1.00 0.43 C ATOM 227 NH1 ARG A 15 25.843 -8.560 -2.226 1.00 50.34 N ATOM 228 NH2 ARG A 15 27.578 -8.494 -3.727 1.00 55.33 N ATOM 0 H ARG A 15 23.661 -9.574 -8.793 1.00 54.05 H new ATOM 0 HA ARG A 15 21.600 -8.430 -7.362 1.00 12.11 H new ATOM 0 HB2 ARG A 15 24.561 -8.609 -7.175 1.00 74.42 H new ATOM 0 HB3 ARG A 15 23.850 -7.288 -6.268 1.00 74.42 H new ATOM 0 HG2 ARG A 15 22.185 -9.203 -5.433 1.00 43.13 H new ATOM 0 HG3 ARG A 15 23.515 -10.248 -5.890 1.00 43.13 H new ATOM 0 HD2 ARG A 15 23.578 -7.957 -3.894 1.00 22.45 H new ATOM 0 HD3 ARG A 15 23.775 -9.665 -3.554 1.00 22.45 H new ATOM 0 HE ARG A 15 25.788 -8.792 -5.430 1.00 11.43 H new ATOM 0 HH11 ARG A 15 24.846 -8.645 -2.030 1.00 50.34 H new ATOM 0 HH12 ARG A 15 26.505 -8.440 -1.459 1.00 50.34 H new ATOM 0 HH21 ARG A 15 27.918 -8.528 -4.688 1.00 55.33 H new ATOM 0 HH22 ARG A 15 28.236 -8.374 -2.957 1.00 55.33 H new ATOM 242 N ALA A 16 23.303 -6.234 -9.117 1.00 64.41 N ATOM 243 CA ALA A 16 23.299 -4.860 -9.603 1.00 74.45 C ATOM 244 C ALA A 16 22.233 -4.661 -10.676 1.00 31.32 C ATOM 245 O ALA A 16 21.504 -3.668 -10.665 1.00 20.35 O ATOM 246 CB ALA A 16 24.671 -4.487 -10.145 1.00 32.42 C ATOM 0 H ALA A 16 24.011 -6.831 -9.546 1.00 64.41 H new ATOM 0 HA ALA A 16 23.062 -4.205 -8.765 1.00 74.45 H new ATOM 0 HB1 ALA A 16 24.653 -3.458 -10.504 1.00 32.42 H new ATOM 0 HB2 ALA A 16 25.413 -4.581 -9.352 1.00 32.42 H new ATOM 0 HB3 ALA A 16 24.931 -5.154 -10.967 1.00 32.42 H new ATOM 252 N LEU A 17 22.147 -5.610 -11.601 1.00 63.25 N ATOM 253 CA LEU A 17 21.170 -5.539 -12.682 1.00 42.24 C ATOM 254 C LEU A 17 19.766 -5.312 -12.133 1.00 34.45 C ATOM 255 O LEU A 17 19.131 -4.297 -12.420 1.00 52.31 O ATOM 256 CB LEU A 17 21.204 -6.823 -13.513 1.00 3.11 C ATOM 257 CG LEU A 17 20.362 -6.819 -14.789 1.00 64.33 C ATOM 258 CD1 LEU A 17 18.894 -7.043 -14.461 1.00 65.51 C ATOM 259 CD2 LEU A 17 20.548 -5.513 -15.547 1.00 11.41 C ATOM 0 H LEU A 17 22.742 -6.438 -11.624 1.00 63.25 H new ATOM 0 HA LEU A 17 21.432 -4.694 -13.320 1.00 42.24 H new ATOM 0 HB2 LEU A 17 22.239 -7.028 -13.785 1.00 3.11 H new ATOM 0 HB3 LEU A 17 20.870 -7.648 -12.884 1.00 3.11 H new ATOM 0 HG LEU A 17 20.699 -7.637 -15.426 1.00 64.33 H new ATOM 0 HD11 LEU A 17 18.310 -7.037 -15.382 1.00 65.51 H new ATOM 0 HD12 LEU A 17 18.775 -8.005 -13.962 1.00 65.51 H new ATOM 0 HD13 LEU A 17 18.543 -6.248 -13.803 1.00 65.51 H new ATOM 0 HD21 LEU A 17 19.941 -5.528 -16.452 1.00 11.41 H new ATOM 0 HD22 LEU A 17 20.239 -4.679 -14.917 1.00 11.41 H new ATOM 0 HD23 LEU A 17 21.598 -5.395 -15.816 1.00 11.41 H new ATOM 271 N LEU A 18 19.286 -6.264 -11.339 1.00 3.32 N ATOM 272 CA LEU A 18 17.957 -6.168 -10.746 1.00 11.52 C ATOM 273 C LEU A 18 17.833 -4.912 -9.888 1.00 74.23 C ATOM 274 O LEU A 18 16.852 -4.174 -9.988 1.00 42.23 O ATOM 275 CB LEU A 18 17.663 -7.408 -9.900 1.00 3.21 C ATOM 276 CG LEU A 18 17.907 -8.756 -10.579 1.00 24.15 C ATOM 277 CD1 LEU A 18 17.872 -9.882 -9.557 1.00 32.11 C ATOM 278 CD2 LEU A 18 16.879 -8.995 -11.675 1.00 24.43 C ATOM 0 H LEU A 18 19.798 -7.111 -11.091 1.00 3.32 H new ATOM 0 HA LEU A 18 17.229 -6.107 -11.555 1.00 11.52 H new ATOM 0 HB2 LEU A 18 18.274 -7.362 -8.999 1.00 3.21 H new ATOM 0 HB3 LEU A 18 16.621 -7.367 -9.581 1.00 3.21 H new ATOM 0 HG LEU A 18 18.897 -8.738 -11.035 1.00 24.15 H new ATOM 0 HD11 LEU A 18 18.048 -10.834 -10.058 1.00 32.11 H new ATOM 0 HD12 LEU A 18 18.647 -9.718 -8.808 1.00 32.11 H new ATOM 0 HD13 LEU A 18 16.896 -9.902 -9.071 1.00 32.11 H new ATOM 0 HD21 LEU A 18 17.068 -9.959 -12.147 1.00 24.43 H new ATOM 0 HD22 LEU A 18 15.879 -8.993 -11.242 1.00 24.43 H new ATOM 0 HD23 LEU A 18 16.953 -8.204 -12.422 1.00 24.43 H new ATOM 290 N HIS A 19 18.834 -4.675 -9.047 1.00 31.03 N ATOM 291 CA HIS A 19 18.838 -3.507 -8.173 1.00 41.24 C ATOM 292 C HIS A 19 18.592 -2.230 -8.972 1.00 61.42 C ATOM 293 O HIS A 19 17.819 -1.367 -8.558 1.00 60.03 O ATOM 294 CB HIS A 19 20.169 -3.407 -7.427 1.00 14.42 C ATOM 295 CG HIS A 19 20.291 -2.175 -6.583 1.00 34.43 C ATOM 296 ND1 HIS A 19 21.501 -1.679 -6.146 1.00 32.31 N ATOM 297 CD2 HIS A 19 19.345 -1.338 -6.096 1.00 72.15 C ATOM 298 CE1 HIS A 19 21.294 -0.591 -5.426 1.00 71.11 C ATOM 299 NE2 HIS A 19 19.994 -0.362 -5.381 1.00 71.11 N ATOM 0 H HIS A 19 19.653 -5.276 -8.952 1.00 31.03 H new ATOM 0 HA HIS A 19 18.032 -3.623 -7.449 1.00 41.24 H new ATOM 0 HB2 HIS A 19 20.288 -4.285 -6.793 1.00 14.42 H new ATOM 0 HB3 HIS A 19 20.984 -3.424 -8.151 1.00 14.42 H new ATOM 0 HD2 HIS A 19 18.278 -1.422 -6.243 1.00 72.15 H new ATOM 0 HE1 HIS A 19 22.058 0.009 -4.954 1.00 71.11 H new ATOM 0 HE2 HIS A 19 19.545 0.414 -4.894 1.00 71.11 H new ATOM 307 N ALA A 20 19.256 -2.118 -10.118 1.00 74.23 N ATOM 308 CA ALA A 20 19.108 -0.948 -10.975 1.00 71.41 C ATOM 309 C ALA A 20 17.738 -0.928 -11.645 1.00 0.22 C ATOM 310 O ALA A 20 17.135 0.132 -11.817 1.00 41.14 O ATOM 311 CB ALA A 20 20.210 -0.919 -12.023 1.00 64.33 C ATOM 0 H ALA A 20 19.901 -2.823 -10.474 1.00 74.23 H new ATOM 0 HA ALA A 20 19.191 -0.058 -10.351 1.00 71.41 H new ATOM 0 HB1 ALA A 20 20.087 -0.040 -12.656 1.00 64.33 H new ATOM 0 HB2 ALA A 20 21.181 -0.878 -11.529 1.00 64.33 H new ATOM 0 HB3 ALA A 20 20.153 -1.818 -12.636 1.00 64.33 H new ATOM 317 N THR A 21 17.251 -2.106 -12.022 1.00 13.04 N ATOM 318 CA THR A 21 15.953 -2.223 -12.674 1.00 51.12 C ATOM 319 C THR A 21 14.871 -1.498 -11.881 1.00 64.12 C ATOM 320 O THR A 21 14.146 -0.662 -12.422 1.00 32.24 O ATOM 321 CB THR A 21 15.543 -3.697 -12.850 1.00 63.40 C ATOM 322 OG1 THR A 21 16.679 -4.478 -13.238 1.00 21.40 O ATOM 323 CG2 THR A 21 14.447 -3.833 -13.896 1.00 31.43 C ATOM 0 H THR A 21 17.736 -2.993 -11.887 1.00 13.04 H new ATOM 0 HA THR A 21 16.051 -1.761 -13.656 1.00 51.12 H new ATOM 0 HB THR A 21 15.160 -4.061 -11.897 1.00 63.40 H new ATOM 0 HG1 THR A 21 17.377 -4.402 -12.555 1.00 21.40 H new ATOM 0 HG21 THR A 21 14.174 -4.883 -14.003 1.00 31.43 H new ATOM 0 HG22 THR A 21 13.573 -3.261 -13.584 1.00 31.43 H new ATOM 0 HG23 THR A 21 14.807 -3.453 -14.852 1.00 31.43 H new ATOM 331 N LEU A 22 14.769 -1.822 -10.597 1.00 74.20 N ATOM 332 CA LEU A 22 13.775 -1.201 -9.728 1.00 41.32 C ATOM 333 C LEU A 22 14.223 0.193 -9.298 1.00 60.44 C ATOM 334 O LEU A 22 13.422 1.125 -9.249 1.00 14.15 O ATOM 335 CB LEU A 22 13.530 -2.073 -8.496 1.00 14.23 C ATOM 336 CG LEU A 22 12.465 -3.160 -8.644 1.00 62.43 C ATOM 337 CD1 LEU A 22 12.812 -4.368 -7.787 1.00 44.32 C ATOM 338 CD2 LEU A 22 11.093 -2.618 -8.273 1.00 53.34 C ATOM 0 H LEU A 22 15.362 -2.511 -10.134 1.00 74.20 H new ATOM 0 HA LEU A 22 12.845 -1.107 -10.289 1.00 41.32 H new ATOM 0 HB2 LEU A 22 14.471 -2.549 -8.220 1.00 14.23 H new ATOM 0 HB3 LEU A 22 13.246 -1.424 -7.667 1.00 14.23 H new ATOM 0 HG LEU A 22 12.439 -3.475 -9.687 1.00 62.43 H new ATOM 0 HD11 LEU A 22 12.043 -5.131 -7.905 1.00 44.32 H new ATOM 0 HD12 LEU A 22 13.775 -4.772 -8.100 1.00 44.32 H new ATOM 0 HD13 LEU A 22 12.867 -4.068 -6.741 1.00 44.32 H new ATOM 0 HD21 LEU A 22 10.348 -3.406 -8.385 1.00 53.34 H new ATOM 0 HD22 LEU A 22 11.105 -2.274 -7.239 1.00 53.34 H new ATOM 0 HD23 LEU A 22 10.841 -1.785 -8.929 1.00 53.34 H new ATOM 350 N ALA A 23 15.509 0.326 -8.991 1.00 10.52 N ATOM 351 CA ALA A 23 16.064 1.607 -8.570 1.00 25.44 C ATOM 352 C ALA A 23 15.700 2.713 -9.553 1.00 41.42 C ATOM 353 O ALA A 23 15.227 3.777 -9.156 1.00 15.43 O ATOM 354 CB ALA A 23 17.575 1.504 -8.424 1.00 25.24 C ATOM 0 H ALA A 23 16.186 -0.437 -9.026 1.00 10.52 H new ATOM 0 HA ALA A 23 15.632 1.862 -7.602 1.00 25.44 H new ATOM 0 HB1 ALA A 23 17.977 2.467 -8.109 1.00 25.24 H new ATOM 0 HB2 ALA A 23 17.818 0.748 -7.677 1.00 25.24 H new ATOM 0 HB3 ALA A 23 18.015 1.223 -9.381 1.00 25.24 H new ATOM 360 N GLN A 24 15.925 2.455 -10.837 1.00 41.14 N ATOM 361 CA GLN A 24 15.621 3.431 -11.877 1.00 43.30 C ATOM 362 C GLN A 24 14.122 3.701 -11.949 1.00 10.53 C ATOM 363 O GLN A 24 13.696 4.812 -12.266 1.00 30.44 O ATOM 364 CB GLN A 24 16.128 2.938 -13.233 1.00 60.23 C ATOM 365 CG GLN A 24 17.644 2.876 -13.331 1.00 12.03 C ATOM 366 CD GLN A 24 18.279 4.249 -13.423 1.00 41.34 C ATOM 367 OE1 GLN A 24 19.141 4.603 -12.618 1.00 62.24 O ATOM 368 NE2 GLN A 24 17.856 5.032 -14.409 1.00 13.54 N ATOM 0 H GLN A 24 16.317 1.579 -11.182 1.00 41.14 H new ATOM 0 HA GLN A 24 16.128 4.362 -11.625 1.00 43.30 H new ATOM 0 HB2 GLN A 24 15.719 1.946 -13.425 1.00 60.23 H new ATOM 0 HB3 GLN A 24 15.749 3.596 -14.014 1.00 60.23 H new ATOM 0 HG2 GLN A 24 18.040 2.355 -12.459 1.00 12.03 H new ATOM 0 HG3 GLN A 24 17.924 2.291 -14.207 1.00 12.03 H new ATOM 0 HE21 GLN A 24 17.140 4.698 -15.054 1.00 13.54 H new ATOM 0 HE22 GLN A 24 18.248 5.967 -14.521 1.00 13.54 H new ATOM 377 N ALA A 25 13.327 2.679 -11.653 1.00 34.34 N ATOM 378 CA ALA A 25 11.875 2.807 -11.682 1.00 31.50 C ATOM 379 C ALA A 25 11.383 3.731 -10.573 1.00 74.53 C ATOM 380 O ALA A 25 10.278 4.268 -10.644 1.00 43.04 O ATOM 381 CB ALA A 25 11.222 1.438 -11.560 1.00 20.34 C ATOM 0 H ALA A 25 13.664 1.753 -11.390 1.00 34.34 H new ATOM 0 HA ALA A 25 11.593 3.248 -12.638 1.00 31.50 H new ATOM 0 HB1 ALA A 25 10.138 1.549 -11.583 1.00 20.34 H new ATOM 0 HB2 ALA A 25 11.540 0.808 -12.390 1.00 20.34 H new ATOM 0 HB3 ALA A 25 11.520 0.976 -10.619 1.00 20.34 H new ATOM 387 N GLY A 26 12.210 3.910 -9.548 1.00 11.31 N ATOM 388 CA GLY A 26 11.840 4.769 -8.438 1.00 41.32 C ATOM 389 C GLY A 26 11.863 4.041 -7.109 1.00 1.42 C ATOM 390 O GLY A 26 12.313 4.588 -6.101 1.00 40.15 O ATOM 0 H GLY A 26 13.129 3.476 -9.466 1.00 11.31 H new ATOM 0 HA2 GLY A 26 12.523 5.617 -8.396 1.00 41.32 H new ATOM 0 HA3 GLY A 26 10.842 5.172 -8.611 1.00 41.32 H new ATOM 394 N TYR A 27 11.376 2.806 -7.104 1.00 73.34 N ATOM 395 CA TYR A 27 11.338 2.003 -5.888 1.00 3.24 C ATOM 396 C TYR A 27 12.709 1.963 -5.219 1.00 61.13 C ATOM 397 O TYR A 27 13.736 2.135 -5.875 1.00 21.21 O ATOM 398 CB TYR A 27 10.870 0.582 -6.203 1.00 65.45 C ATOM 399 CG TYR A 27 9.595 0.530 -7.014 1.00 61.20 C ATOM 400 CD1 TYR A 27 9.622 0.219 -8.368 1.00 73.30 C ATOM 401 CD2 TYR A 27 8.364 0.793 -6.426 1.00 71.15 C ATOM 402 CE1 TYR A 27 8.459 0.171 -9.113 1.00 22.11 C ATOM 403 CE2 TYR A 27 7.196 0.746 -7.163 1.00 63.12 C ATOM 404 CZ TYR A 27 7.249 0.435 -8.506 1.00 21.31 C ATOM 405 OH TYR A 27 6.088 0.388 -9.244 1.00 3.35 O ATOM 0 H TYR A 27 11.001 2.338 -7.929 1.00 73.34 H new ATOM 0 HA TYR A 27 10.631 2.466 -5.200 1.00 3.24 H new ATOM 0 HB2 TYR A 27 11.658 0.061 -6.747 1.00 65.45 H new ATOM 0 HB3 TYR A 27 10.718 0.043 -5.268 1.00 65.45 H new ATOM 0 HD1 TYR A 27 10.568 0.011 -8.846 1.00 73.30 H new ATOM 0 HD2 TYR A 27 8.319 1.038 -5.375 1.00 71.15 H new ATOM 0 HE1 TYR A 27 8.497 -0.072 -10.165 1.00 22.11 H new ATOM 0 HE2 TYR A 27 6.247 0.952 -6.690 1.00 63.12 H new ATOM 0 HH TYR A 27 6.188 -0.263 -9.970 1.00 3.35 H new ATOM 415 N GLU A 28 12.715 1.734 -3.910 1.00 23.32 N ATOM 416 CA GLU A 28 13.959 1.671 -3.152 1.00 25.31 C ATOM 417 C GLU A 28 14.313 0.227 -2.806 1.00 2.12 C ATOM 418 O GLU A 28 13.714 -0.374 -1.914 1.00 4.13 O ATOM 419 CB GLU A 28 13.845 2.500 -1.871 1.00 40.33 C ATOM 420 CG GLU A 28 15.179 2.753 -1.189 1.00 12.51 C ATOM 421 CD GLU A 28 16.182 3.431 -2.102 1.00 10.20 C ATOM 422 OE1 GLU A 28 16.307 4.671 -2.030 1.00 3.51 O ATOM 423 OE2 GLU A 28 16.842 2.720 -2.889 1.00 11.33 O ATOM 0 H GLU A 28 11.873 1.589 -3.353 1.00 23.32 H new ATOM 0 HA GLU A 28 14.754 2.083 -3.773 1.00 25.31 H new ATOM 0 HB2 GLU A 28 13.380 3.457 -2.108 1.00 40.33 H new ATOM 0 HB3 GLU A 28 13.182 1.987 -1.174 1.00 40.33 H new ATOM 0 HG2 GLU A 28 15.020 3.373 -0.307 1.00 12.51 H new ATOM 0 HG3 GLU A 28 15.591 1.805 -0.843 1.00 12.51 H new ATOM 430 N VAL A 29 15.290 -0.324 -3.519 1.00 4.20 N ATOM 431 CA VAL A 29 15.725 -1.696 -3.288 1.00 62.20 C ATOM 432 C VAL A 29 16.978 -1.737 -2.420 1.00 35.14 C ATOM 433 O VAL A 29 17.687 -0.739 -2.285 1.00 33.32 O ATOM 434 CB VAL A 29 16.009 -2.426 -4.614 1.00 44.45 C ATOM 435 CG1 VAL A 29 15.996 -3.933 -4.409 1.00 1.32 C ATOM 436 CG2 VAL A 29 14.999 -2.015 -5.675 1.00 20.11 C ATOM 0 H VAL A 29 15.795 0.159 -4.262 1.00 4.20 H new ATOM 0 HA VAL A 29 14.911 -2.203 -2.770 1.00 62.20 H new ATOM 0 HB VAL A 29 17.002 -2.140 -4.960 1.00 44.45 H new ATOM 0 HG11 VAL A 29 16.199 -4.431 -5.357 1.00 1.32 H new ATOM 0 HG12 VAL A 29 16.762 -4.208 -3.684 1.00 1.32 H new ATOM 0 HG13 VAL A 29 15.018 -4.241 -4.039 1.00 1.32 H new ATOM 0 HG21 VAL A 29 15.215 -2.540 -6.605 1.00 20.11 H new ATOM 0 HG22 VAL A 29 13.994 -2.270 -5.339 1.00 20.11 H new ATOM 0 HG23 VAL A 29 15.064 -0.940 -5.842 1.00 20.11 H new ATOM 446 N THR A 30 17.246 -2.899 -1.831 1.00 54.14 N ATOM 447 CA THR A 30 18.412 -3.071 -0.975 1.00 42.30 C ATOM 448 C THR A 30 18.909 -4.512 -1.005 1.00 41.54 C ATOM 449 O THR A 30 18.211 -5.429 -0.572 1.00 45.24 O ATOM 450 CB THR A 30 18.103 -2.677 0.482 1.00 73.04 C ATOM 451 OG1 THR A 30 17.684 -1.309 0.541 1.00 74.11 O ATOM 452 CG2 THR A 30 19.323 -2.878 1.367 1.00 1.44 C ATOM 0 H THR A 30 16.670 -3.735 -1.932 1.00 54.14 H new ATOM 0 HA THR A 30 19.189 -2.413 -1.365 1.00 42.30 H new ATOM 0 HB THR A 30 17.300 -3.318 0.846 1.00 73.04 H new ATOM 0 HG1 THR A 30 17.488 -1.067 1.470 1.00 74.11 H new ATOM 0 HG21 THR A 30 19.081 -2.593 2.391 1.00 1.44 H new ATOM 0 HG22 THR A 30 19.621 -3.926 1.343 1.00 1.44 H new ATOM 0 HG23 THR A 30 20.143 -2.259 1.003 1.00 1.44 H new ATOM 460 N VAL A 31 20.120 -4.704 -1.519 1.00 71.42 N ATOM 461 CA VAL A 31 20.711 -6.034 -1.604 1.00 62.42 C ATOM 462 C VAL A 31 21.615 -6.312 -0.408 1.00 13.30 C ATOM 463 O VAL A 31 22.371 -5.443 0.026 1.00 63.52 O ATOM 464 CB VAL A 31 21.527 -6.204 -2.900 1.00 32.22 C ATOM 465 CG1 VAL A 31 20.670 -5.888 -4.116 1.00 13.52 C ATOM 466 CG2 VAL A 31 22.767 -5.324 -2.867 1.00 51.14 C ATOM 0 H VAL A 31 20.710 -3.956 -1.882 1.00 71.42 H new ATOM 0 HA VAL A 31 19.886 -6.747 -1.606 1.00 62.42 H new ATOM 0 HB VAL A 31 21.849 -7.243 -2.973 1.00 32.22 H new ATOM 0 HG11 VAL A 31 21.263 -6.014 -5.022 1.00 13.52 H new ATOM 0 HG12 VAL A 31 19.816 -6.565 -4.145 1.00 13.52 H new ATOM 0 HG13 VAL A 31 20.316 -4.859 -4.054 1.00 13.52 H new ATOM 0 HG21 VAL A 31 23.332 -5.456 -3.790 1.00 51.14 H new ATOM 0 HG22 VAL A 31 22.470 -4.280 -2.770 1.00 51.14 H new ATOM 0 HG23 VAL A 31 23.390 -5.604 -2.017 1.00 51.14 H new ATOM 476 N ALA A 32 21.530 -7.528 0.121 1.00 44.01 N ATOM 477 CA ALA A 32 22.342 -7.921 1.266 1.00 62.11 C ATOM 478 C ALA A 32 23.508 -8.805 0.835 1.00 53.01 C ATOM 479 O ALA A 32 23.715 -9.038 -0.355 1.00 43.25 O ATOM 480 CB ALA A 32 21.486 -8.640 2.298 1.00 10.52 C ATOM 0 H ALA A 32 20.907 -8.258 -0.225 1.00 44.01 H new ATOM 0 HA ALA A 32 22.752 -7.017 1.716 1.00 62.11 H new ATOM 0 HB1 ALA A 32 22.105 -8.928 3.148 1.00 10.52 H new ATOM 0 HB2 ALA A 32 20.691 -7.976 2.637 1.00 10.52 H new ATOM 0 HB3 ALA A 32 21.048 -9.532 1.850 1.00 10.52 H new ATOM 486 N ALA A 33 24.266 -9.294 1.811 1.00 72.12 N ATOM 487 CA ALA A 33 25.410 -10.153 1.532 1.00 74.42 C ATOM 488 C ALA A 33 24.961 -11.566 1.173 1.00 14.13 C ATOM 489 O ALA A 33 25.577 -12.231 0.340 1.00 14.40 O ATOM 490 CB ALA A 33 26.351 -10.184 2.727 1.00 34.11 C ATOM 0 H ALA A 33 24.108 -9.110 2.802 1.00 72.12 H new ATOM 0 HA ALA A 33 25.942 -9.740 0.675 1.00 74.42 H new ATOM 0 HB1 ALA A 33 27.201 -10.829 2.504 1.00 34.11 H new ATOM 0 HB2 ALA A 33 26.707 -9.175 2.936 1.00 34.11 H new ATOM 0 HB3 ALA A 33 25.821 -10.570 3.598 1.00 34.11 H new ATOM 496 N ASP A 34 23.885 -12.019 1.808 1.00 51.51 N ATOM 497 CA ASP A 34 23.353 -13.353 1.555 1.00 1.33 C ATOM 498 C ASP A 34 21.864 -13.415 1.880 1.00 51.40 C ATOM 499 O ASP A 34 21.313 -12.501 2.494 1.00 65.34 O ATOM 500 CB ASP A 34 24.112 -14.392 2.382 1.00 34.20 C ATOM 501 CG ASP A 34 24.049 -15.777 1.769 1.00 64.33 C ATOM 502 OD1 ASP A 34 24.259 -15.893 0.543 1.00 12.12 O ATOM 503 OD2 ASP A 34 23.790 -16.746 2.514 1.00 44.40 O ATOM 0 H ASP A 34 23.364 -11.482 2.501 1.00 51.51 H new ATOM 0 HA ASP A 34 23.485 -13.576 0.496 1.00 1.33 H new ATOM 0 HB2 ASP A 34 25.154 -14.087 2.476 1.00 34.20 H new ATOM 0 HB3 ASP A 34 23.697 -14.424 3.389 1.00 34.20 H new ATOM 508 N GLY A 35 21.217 -14.498 1.462 1.00 34.44 N ATOM 509 CA GLY A 35 19.797 -14.659 1.717 1.00 52.42 C ATOM 510 C GLY A 35 19.469 -14.652 3.197 1.00 53.23 C ATOM 511 O GLY A 35 18.398 -14.198 3.599 1.00 41.22 O ATOM 0 H GLY A 35 21.650 -15.267 0.951 1.00 34.44 H new ATOM 0 HA2 GLY A 35 19.249 -13.857 1.223 1.00 52.42 H new ATOM 0 HA3 GLY A 35 19.456 -15.596 1.277 1.00 52.42 H new ATOM 515 N GLU A 36 20.392 -15.158 4.008 1.00 33.04 N ATOM 516 CA GLU A 36 20.193 -15.210 5.452 1.00 32.30 C ATOM 517 C GLU A 36 20.187 -13.807 6.052 1.00 42.04 C ATOM 518 O GLU A 36 19.309 -13.461 6.841 1.00 32.40 O ATOM 519 CB GLU A 36 21.287 -16.053 6.110 1.00 60.52 C ATOM 520 CG GLU A 36 21.264 -16.003 7.628 1.00 4.23 C ATOM 521 CD GLU A 36 22.084 -17.110 8.261 1.00 30.53 C ATOM 522 OE1 GLU A 36 21.535 -17.843 9.111 1.00 14.51 O ATOM 523 OE2 GLU A 36 23.274 -17.245 7.908 1.00 72.24 O ATOM 0 H GLU A 36 21.284 -15.537 3.691 1.00 33.04 H new ATOM 0 HA GLU A 36 19.224 -15.672 5.643 1.00 32.30 H new ATOM 0 HB2 GLU A 36 21.179 -17.089 5.787 1.00 60.52 H new ATOM 0 HB3 GLU A 36 22.260 -15.709 5.758 1.00 60.52 H new ATOM 0 HG2 GLU A 36 21.645 -15.038 7.962 1.00 4.23 H new ATOM 0 HG3 GLU A 36 20.233 -16.076 7.975 1.00 4.23 H new ATOM 530 N ALA A 37 21.175 -13.003 5.671 1.00 72.32 N ATOM 531 CA ALA A 37 21.284 -11.638 6.169 1.00 53.22 C ATOM 532 C ALA A 37 20.085 -10.799 5.738 1.00 21.21 C ATOM 533 O ALA A 37 19.636 -9.919 6.470 1.00 10.53 O ATOM 534 CB ALA A 37 22.578 -11.001 5.684 1.00 14.21 C ATOM 0 H ALA A 37 21.911 -13.274 5.019 1.00 72.32 H new ATOM 0 HA ALA A 37 21.296 -11.675 7.258 1.00 53.22 H new ATOM 0 HB1 ALA A 37 22.646 -9.981 6.064 1.00 14.21 H new ATOM 0 HB2 ALA A 37 23.427 -11.581 6.046 1.00 14.21 H new ATOM 0 HB3 ALA A 37 22.589 -10.984 4.594 1.00 14.21 H new ATOM 540 N GLY A 38 19.571 -11.079 4.544 1.00 45.42 N ATOM 541 CA GLY A 38 18.430 -10.340 4.036 1.00 30.21 C ATOM 542 C GLY A 38 17.150 -10.670 4.778 1.00 12.50 C ATOM 543 O GLY A 38 16.427 -9.772 5.212 1.00 30.42 O ATOM 0 H GLY A 38 19.924 -11.804 3.920 1.00 45.42 H new ATOM 0 HA2 GLY A 38 18.628 -9.271 4.116 1.00 30.21 H new ATOM 0 HA3 GLY A 38 18.300 -10.561 2.977 1.00 30.21 H new ATOM 547 N PHE A 39 16.867 -11.960 4.923 1.00 50.11 N ATOM 548 CA PHE A 39 15.663 -12.406 5.615 1.00 4.32 C ATOM 549 C PHE A 39 15.695 -11.991 7.083 1.00 1.32 C ATOM 550 O PHE A 39 14.727 -11.437 7.604 1.00 53.32 O ATOM 551 CB PHE A 39 15.520 -13.925 5.506 1.00 31.11 C ATOM 552 CG PHE A 39 14.541 -14.361 4.454 1.00 52.33 C ATOM 553 CD1 PHE A 39 13.227 -13.922 4.487 1.00 40.42 C ATOM 554 CD2 PHE A 39 14.934 -15.209 3.431 1.00 2.21 C ATOM 555 CE1 PHE A 39 12.324 -14.322 3.520 1.00 10.41 C ATOM 556 CE2 PHE A 39 14.036 -15.612 2.461 1.00 15.03 C ATOM 557 CZ PHE A 39 12.729 -15.167 2.505 1.00 11.24 C ATOM 0 H PHE A 39 17.455 -12.715 4.571 1.00 50.11 H new ATOM 0 HA PHE A 39 14.804 -11.932 5.140 1.00 4.32 H new ATOM 0 HB2 PHE A 39 16.495 -14.359 5.285 1.00 31.11 H new ATOM 0 HB3 PHE A 39 15.205 -14.322 6.471 1.00 31.11 H new ATOM 0 HD1 PHE A 39 12.905 -13.260 5.277 1.00 40.42 H new ATOM 0 HD2 PHE A 39 15.955 -15.559 3.391 1.00 2.21 H new ATOM 0 HE1 PHE A 39 11.302 -13.974 3.558 1.00 10.41 H new ATOM 0 HE2 PHE A 39 14.356 -16.274 1.670 1.00 15.03 H new ATOM 0 HZ PHE A 39 12.025 -15.479 1.747 1.00 11.24 H new ATOM 567 N ASP A 40 16.814 -12.263 7.745 1.00 64.24 N ATOM 568 CA ASP A 40 16.974 -11.918 9.153 1.00 72.34 C ATOM 569 C ASP A 40 16.619 -10.455 9.397 1.00 4.20 C ATOM 570 O ASP A 40 16.063 -10.105 10.439 1.00 23.21 O ATOM 571 CB ASP A 40 18.408 -12.191 9.607 1.00 24.33 C ATOM 572 CG ASP A 40 18.503 -12.459 11.097 1.00 54.24 C ATOM 573 OD1 ASP A 40 17.536 -12.139 11.820 1.00 53.43 O ATOM 574 OD2 ASP A 40 19.543 -12.989 11.539 1.00 32.01 O ATOM 0 H ASP A 40 17.624 -12.722 7.329 1.00 64.24 H new ATOM 0 HA ASP A 40 16.293 -12.540 9.734 1.00 72.34 H new ATOM 0 HB2 ASP A 40 18.802 -13.048 9.061 1.00 24.33 H new ATOM 0 HB3 ASP A 40 19.035 -11.336 9.354 1.00 24.33 H new ATOM 579 N LEU A 41 16.946 -9.603 8.431 1.00 34.20 N ATOM 580 CA LEU A 41 16.663 -8.176 8.541 1.00 33.32 C ATOM 581 C LEU A 41 15.252 -7.862 8.054 1.00 10.41 C ATOM 582 O LEU A 41 14.609 -6.932 8.541 1.00 4.02 O ATOM 583 CB LEU A 41 17.684 -7.370 7.737 1.00 60.32 C ATOM 584 CG LEU A 41 19.134 -7.455 8.216 1.00 14.20 C ATOM 585 CD1 LEU A 41 20.063 -6.766 7.229 1.00 62.00 C ATOM 586 CD2 LEU A 41 19.274 -6.841 9.601 1.00 10.23 C ATOM 0 H LEU A 41 17.407 -9.876 7.563 1.00 34.20 H new ATOM 0 HA LEU A 41 16.735 -7.896 9.592 1.00 33.32 H new ATOM 0 HB2 LEU A 41 17.645 -7.703 6.700 1.00 60.32 H new ATOM 0 HB3 LEU A 41 17.380 -6.323 7.747 1.00 60.32 H new ATOM 0 HG LEU A 41 19.416 -8.506 8.276 1.00 14.20 H new ATOM 0 HD11 LEU A 41 21.090 -6.836 7.586 1.00 62.00 H new ATOM 0 HD12 LEU A 41 19.983 -7.250 6.256 1.00 62.00 H new ATOM 0 HD13 LEU A 41 19.782 -5.717 7.137 1.00 62.00 H new ATOM 0 HD21 LEU A 41 20.312 -6.910 9.926 1.00 10.23 H new ATOM 0 HD22 LEU A 41 18.973 -5.794 9.567 1.00 10.23 H new ATOM 0 HD23 LEU A 41 18.637 -7.379 10.303 1.00 10.23 H new ATOM 598 N ALA A 42 14.776 -8.644 7.091 1.00 34.23 N ATOM 599 CA ALA A 42 13.440 -8.452 6.541 1.00 15.34 C ATOM 600 C ALA A 42 12.385 -8.471 7.642 1.00 33.55 C ATOM 601 O ALA A 42 11.307 -7.896 7.493 1.00 61.30 O ATOM 602 CB ALA A 42 13.138 -9.520 5.500 1.00 5.42 C ATOM 0 H ALA A 42 15.296 -9.417 6.675 1.00 34.23 H new ATOM 0 HA ALA A 42 13.410 -7.474 6.061 1.00 15.34 H new ATOM 0 HB1 ALA A 42 12.137 -9.364 5.098 1.00 5.42 H new ATOM 0 HB2 ALA A 42 13.867 -9.457 4.692 1.00 5.42 H new ATOM 0 HB3 ALA A 42 13.193 -10.505 5.963 1.00 5.42 H new ATOM 608 N ALA A 43 12.702 -9.138 8.748 1.00 41.42 N ATOM 609 CA ALA A 43 11.782 -9.231 9.874 1.00 12.13 C ATOM 610 C ALA A 43 11.885 -8.002 10.771 1.00 40.43 C ATOM 611 O ALA A 43 10.931 -7.641 11.461 1.00 21.44 O ATOM 612 CB ALA A 43 12.055 -10.495 10.676 1.00 71.25 C ATOM 0 H ALA A 43 13.589 -9.622 8.887 1.00 41.42 H new ATOM 0 HA ALA A 43 10.767 -9.276 9.478 1.00 12.13 H new ATOM 0 HB1 ALA A 43 11.360 -10.551 11.514 1.00 71.25 H new ATOM 0 HB2 ALA A 43 11.923 -11.367 10.036 1.00 71.25 H new ATOM 0 HB3 ALA A 43 13.077 -10.473 11.053 1.00 71.25 H new ATOM 618 N THR A 44 13.050 -7.360 10.756 1.00 34.34 N ATOM 619 CA THR A 44 13.278 -6.172 11.569 1.00 21.53 C ATOM 620 C THR A 44 12.902 -4.906 10.809 1.00 5.43 C ATOM 621 O THR A 44 12.529 -3.897 11.409 1.00 51.44 O ATOM 622 CB THR A 44 14.749 -6.072 12.017 1.00 74.34 C ATOM 623 OG1 THR A 44 14.819 -5.594 13.364 1.00 1.15 O ATOM 624 CG2 THR A 44 15.530 -5.142 11.101 1.00 24.04 C ATOM 0 H THR A 44 13.850 -7.643 10.190 1.00 34.34 H new ATOM 0 HA THR A 44 12.643 -6.265 12.450 1.00 21.53 H new ATOM 0 HB THR A 44 15.192 -7.066 11.962 1.00 74.34 H new ATOM 0 HG1 THR A 44 15.757 -5.535 13.642 1.00 1.15 H new ATOM 0 HG21 THR A 44 16.566 -5.087 11.436 1.00 24.04 H new ATOM 0 HG22 THR A 44 15.499 -5.525 10.081 1.00 24.04 H new ATOM 0 HG23 THR A 44 15.086 -4.147 11.129 1.00 24.04 H new ATOM 632 N THR A 45 13.003 -4.964 9.485 1.00 50.41 N ATOM 633 CA THR A 45 12.674 -3.821 8.643 1.00 42.54 C ATOM 634 C THR A 45 11.290 -3.974 8.023 1.00 13.05 C ATOM 635 O THR A 45 10.553 -2.999 7.879 1.00 74.22 O ATOM 636 CB THR A 45 13.710 -3.636 7.517 1.00 13.54 C ATOM 637 OG1 THR A 45 14.924 -3.097 8.053 1.00 53.35 O ATOM 638 CG2 THR A 45 13.173 -2.712 6.435 1.00 52.35 C ATOM 0 H THR A 45 13.310 -5.791 8.973 1.00 50.41 H new ATOM 0 HA THR A 45 12.686 -2.941 9.287 1.00 42.54 H new ATOM 0 HB THR A 45 13.911 -4.611 7.073 1.00 13.54 H new ATOM 0 HG1 THR A 45 15.578 -2.984 7.332 1.00 53.35 H new ATOM 0 HG21 THR A 45 13.921 -2.596 5.651 1.00 52.35 H new ATOM 0 HG22 THR A 45 12.265 -3.139 6.010 1.00 52.35 H new ATOM 0 HG23 THR A 45 12.947 -1.737 6.868 1.00 52.35 H new ATOM 646 N ALA A 46 10.942 -5.204 7.660 1.00 21.21 N ATOM 647 CA ALA A 46 9.644 -5.485 7.059 1.00 63.20 C ATOM 648 C ALA A 46 9.510 -4.806 5.700 1.00 11.24 C ATOM 649 O ALA A 46 8.891 -3.748 5.583 1.00 74.10 O ATOM 650 CB ALA A 46 8.525 -5.039 7.988 1.00 53.25 C ATOM 0 H ALA A 46 11.541 -6.022 7.772 1.00 21.21 H new ATOM 0 HA ALA A 46 9.567 -6.562 6.907 1.00 63.20 H new ATOM 0 HB1 ALA A 46 7.561 -5.255 7.527 1.00 53.25 H new ATOM 0 HB2 ALA A 46 8.602 -5.575 8.934 1.00 53.25 H new ATOM 0 HB3 ALA A 46 8.608 -3.968 8.170 1.00 53.25 H new ATOM 656 N TYR A 47 10.094 -5.419 4.677 1.00 21.22 N ATOM 657 CA TYR A 47 10.042 -4.871 3.327 1.00 60.41 C ATOM 658 C TYR A 47 8.733 -5.245 2.637 1.00 24.24 C ATOM 659 O TYR A 47 7.869 -5.891 3.230 1.00 70.31 O ATOM 660 CB TYR A 47 11.228 -5.376 2.503 1.00 32.41 C ATOM 661 CG TYR A 47 12.568 -4.899 3.015 1.00 51.51 C ATOM 662 CD1 TYR A 47 13.176 -5.510 4.104 1.00 10.44 C ATOM 663 CD2 TYR A 47 13.227 -3.836 2.408 1.00 74.22 C ATOM 664 CE1 TYR A 47 14.400 -5.076 4.576 1.00 51.44 C ATOM 665 CE2 TYR A 47 14.451 -3.396 2.871 1.00 25.43 C ATOM 666 CZ TYR A 47 15.034 -4.019 3.956 1.00 53.03 C ATOM 667 OH TYR A 47 16.254 -3.585 4.421 1.00 14.32 O ATOM 0 H TYR A 47 10.609 -6.296 4.757 1.00 21.22 H new ATOM 0 HA TYR A 47 10.095 -3.785 3.401 1.00 60.41 H new ATOM 0 HB2 TYR A 47 11.218 -6.466 2.497 1.00 32.41 H new ATOM 0 HB3 TYR A 47 11.107 -5.051 1.470 1.00 32.41 H new ATOM 0 HD1 TYR A 47 12.683 -6.339 4.590 1.00 10.44 H new ATOM 0 HD2 TYR A 47 12.773 -3.346 1.559 1.00 74.22 H new ATOM 0 HE1 TYR A 47 14.858 -5.561 5.425 1.00 51.44 H new ATOM 0 HE2 TYR A 47 14.949 -2.569 2.387 1.00 25.43 H new ATOM 0 HH TYR A 47 16.564 -2.834 3.873 1.00 14.32 H new ATOM 677 N ASP A 48 8.596 -4.834 1.382 1.00 71.43 N ATOM 678 CA ASP A 48 7.394 -5.127 0.609 1.00 42.41 C ATOM 679 C ASP A 48 7.620 -6.318 -0.317 1.00 34.25 C ATOM 680 O ASP A 48 6.696 -7.082 -0.599 1.00 34.21 O ATOM 681 CB ASP A 48 6.977 -3.903 -0.208 1.00 0.52 C ATOM 682 CG ASP A 48 6.028 -2.996 0.551 1.00 32.21 C ATOM 683 OD1 ASP A 48 4.830 -2.963 0.199 1.00 51.20 O ATOM 684 OD2 ASP A 48 6.483 -2.321 1.498 1.00 54.02 O ATOM 0 H ASP A 48 9.302 -4.297 0.878 1.00 71.43 H new ATOM 0 HA ASP A 48 6.595 -5.379 1.307 1.00 42.41 H new ATOM 0 HB2 ASP A 48 7.866 -3.339 -0.491 1.00 0.52 H new ATOM 0 HB3 ASP A 48 6.500 -4.231 -1.132 1.00 0.52 H new ATOM 689 N LEU A 49 8.853 -6.471 -0.787 1.00 13.54 N ATOM 690 CA LEU A 49 9.200 -7.569 -1.682 1.00 10.13 C ATOM 691 C LEU A 49 10.608 -8.081 -1.395 1.00 11.23 C ATOM 692 O LEU A 49 11.574 -7.318 -1.415 1.00 14.51 O ATOM 693 CB LEU A 49 9.097 -7.117 -3.139 1.00 74.15 C ATOM 694 CG LEU A 49 8.579 -8.160 -4.130 1.00 73.33 C ATOM 695 CD1 LEU A 49 8.567 -7.596 -5.542 1.00 51.43 C ATOM 696 CD2 LEU A 49 9.425 -9.423 -4.066 1.00 70.30 C ATOM 0 H LEU A 49 9.629 -5.848 -0.563 1.00 13.54 H new ATOM 0 HA LEU A 49 8.495 -8.382 -1.510 1.00 10.13 H new ATOM 0 HB2 LEU A 49 8.442 -6.247 -3.183 1.00 74.15 H new ATOM 0 HB3 LEU A 49 10.084 -6.791 -3.468 1.00 74.15 H new ATOM 0 HG LEU A 49 7.556 -8.417 -3.855 1.00 73.33 H new ATOM 0 HD11 LEU A 49 8.195 -8.353 -6.233 1.00 51.43 H new ATOM 0 HD12 LEU A 49 7.918 -6.721 -5.579 1.00 51.43 H new ATOM 0 HD13 LEU A 49 9.579 -7.309 -5.828 1.00 51.43 H new ATOM 0 HD21 LEU A 49 9.042 -10.154 -4.778 1.00 70.30 H new ATOM 0 HD22 LEU A 49 10.458 -9.182 -4.315 1.00 70.30 H new ATOM 0 HD23 LEU A 49 9.382 -9.839 -3.060 1.00 70.30 H new ATOM 708 N VAL A 50 10.718 -9.379 -1.129 1.00 55.23 N ATOM 709 CA VAL A 50 12.008 -9.994 -0.842 1.00 13.04 C ATOM 710 C VAL A 50 12.336 -11.083 -1.857 1.00 41.40 C ATOM 711 O VAL A 50 11.461 -11.842 -2.275 1.00 33.04 O ATOM 712 CB VAL A 50 12.037 -10.602 0.573 1.00 13.55 C ATOM 713 CG1 VAL A 50 13.442 -11.061 0.929 1.00 45.12 C ATOM 714 CG2 VAL A 50 11.521 -9.598 1.594 1.00 33.51 C ATOM 0 H VAL A 50 9.929 -10.025 -1.106 1.00 55.23 H new ATOM 0 HA VAL A 50 12.756 -9.204 -0.906 1.00 13.04 H new ATOM 0 HB VAL A 50 11.382 -11.473 0.589 1.00 13.55 H new ATOM 0 HG11 VAL A 50 13.442 -11.488 1.932 1.00 45.12 H new ATOM 0 HG12 VAL A 50 13.771 -11.815 0.214 1.00 45.12 H new ATOM 0 HG13 VAL A 50 14.122 -10.210 0.897 1.00 45.12 H new ATOM 0 HG21 VAL A 50 11.548 -10.044 2.588 1.00 33.51 H new ATOM 0 HG22 VAL A 50 12.149 -8.707 1.578 1.00 33.51 H new ATOM 0 HG23 VAL A 50 10.495 -9.323 1.348 1.00 33.51 H new ATOM 724 N LEU A 51 13.603 -11.154 -2.251 1.00 12.13 N ATOM 725 CA LEU A 51 14.048 -12.151 -3.218 1.00 5.02 C ATOM 726 C LEU A 51 15.307 -12.860 -2.728 1.00 42.13 C ATOM 727 O LEU A 51 16.273 -12.219 -2.312 1.00 14.41 O ATOM 728 CB LEU A 51 14.314 -11.493 -4.573 1.00 4.32 C ATOM 729 CG LEU A 51 13.302 -10.436 -5.016 1.00 11.01 C ATOM 730 CD1 LEU A 51 13.854 -9.620 -6.174 1.00 5.20 C ATOM 731 CD2 LEU A 51 11.983 -11.090 -5.403 1.00 5.10 C ATOM 0 H LEU A 51 14.340 -10.533 -1.916 1.00 12.13 H new ATOM 0 HA LEU A 51 13.256 -12.892 -3.330 1.00 5.02 H new ATOM 0 HB2 LEU A 51 15.301 -11.032 -4.543 1.00 4.32 H new ATOM 0 HB3 LEU A 51 14.350 -12.274 -5.333 1.00 4.32 H new ATOM 0 HG LEU A 51 13.119 -9.762 -4.179 1.00 11.01 H new ATOM 0 HD11 LEU A 51 13.120 -8.873 -6.475 1.00 5.20 H new ATOM 0 HD12 LEU A 51 14.772 -9.121 -5.863 1.00 5.20 H new ATOM 0 HD13 LEU A 51 14.067 -10.280 -7.015 1.00 5.20 H new ATOM 0 HD21 LEU A 51 11.274 -10.323 -5.716 1.00 5.10 H new ATOM 0 HD22 LEU A 51 12.150 -11.787 -6.225 1.00 5.10 H new ATOM 0 HD23 LEU A 51 11.579 -11.629 -4.546 1.00 5.10 H new ATOM 743 N THR A 52 15.291 -14.188 -2.783 1.00 24.21 N ATOM 744 CA THR A 52 16.431 -14.985 -2.346 1.00 42.34 C ATOM 745 C THR A 52 16.789 -16.045 -3.381 1.00 62.50 C ATOM 746 O THR A 52 15.987 -16.367 -4.258 1.00 13.13 O ATOM 747 CB THR A 52 16.152 -15.673 -0.997 1.00 75.53 C ATOM 748 OG1 THR A 52 17.292 -16.438 -0.592 1.00 5.34 O ATOM 749 CG2 THR A 52 14.935 -16.582 -1.095 1.00 42.23 C ATOM 0 H THR A 52 14.501 -14.735 -3.126 1.00 24.21 H new ATOM 0 HA THR A 52 17.270 -14.299 -2.228 1.00 42.34 H new ATOM 0 HB THR A 52 15.951 -14.900 -0.255 1.00 75.53 H new ATOM 0 HG1 THR A 52 17.249 -16.603 0.373 1.00 5.34 H new ATOM 0 HG21 THR A 52 14.757 -17.057 -0.130 1.00 42.23 H new ATOM 0 HG22 THR A 52 14.062 -15.992 -1.375 1.00 42.23 H new ATOM 0 HG23 THR A 52 15.113 -17.348 -1.850 1.00 42.23 H new ATOM 757 N ASP A 53 17.998 -16.586 -3.273 1.00 73.21 N ATOM 758 CA ASP A 53 18.461 -17.613 -4.199 1.00 24.11 C ATOM 759 C ASP A 53 19.571 -18.450 -3.571 1.00 21.34 C ATOM 760 O ASP A 53 20.660 -17.948 -3.296 1.00 44.44 O ATOM 761 CB ASP A 53 18.960 -16.973 -5.496 1.00 21.25 C ATOM 762 CG ASP A 53 20.155 -16.068 -5.272 1.00 2.41 C ATOM 763 OD1 ASP A 53 20.078 -15.193 -4.384 1.00 43.01 O ATOM 764 OD2 ASP A 53 21.167 -16.233 -5.985 1.00 41.12 O ATOM 0 H ASP A 53 18.675 -16.330 -2.554 1.00 73.21 H new ATOM 0 HA ASP A 53 17.620 -18.268 -4.426 1.00 24.11 H new ATOM 0 HB2 ASP A 53 19.229 -17.757 -6.204 1.00 21.25 H new ATOM 0 HB3 ASP A 53 18.152 -16.398 -5.948 1.00 21.25 H new ATOM 769 N GLN A 54 19.285 -19.729 -3.345 1.00 4.51 N ATOM 770 CA GLN A 54 20.259 -20.634 -2.747 1.00 62.30 C ATOM 771 C GLN A 54 19.721 -22.061 -2.703 1.00 52.44 C ATOM 772 O GLN A 54 18.510 -22.278 -2.722 1.00 22.02 O ATOM 773 CB GLN A 54 20.620 -20.169 -1.335 1.00 61.32 C ATOM 774 CG GLN A 54 19.447 -20.191 -0.369 1.00 54.30 C ATOM 775 CD GLN A 54 19.841 -20.661 1.017 1.00 14.34 C ATOM 776 OE1 GLN A 54 20.517 -19.947 1.759 1.00 54.33 O ATOM 777 NE2 GLN A 54 19.419 -21.868 1.376 1.00 53.33 N ATOM 0 H GLN A 54 18.388 -20.161 -3.567 1.00 4.51 H new ATOM 0 HA GLN A 54 21.156 -20.622 -3.366 1.00 62.30 H new ATOM 0 HB2 GLN A 54 21.414 -20.805 -0.944 1.00 61.32 H new ATOM 0 HB3 GLN A 54 21.019 -19.156 -1.386 1.00 61.32 H new ATOM 0 HG2 GLN A 54 19.018 -19.191 -0.301 1.00 54.30 H new ATOM 0 HG3 GLN A 54 18.669 -20.845 -0.763 1.00 54.30 H new ATOM 0 HE21 GLN A 54 18.861 -22.426 0.730 1.00 53.33 H new ATOM 0 HE22 GLN A 54 19.653 -22.237 2.298 1.00 53.33 H new ATOM 786 N ASN A 55 20.629 -23.029 -2.646 1.00 21.22 N ATOM 787 CA ASN A 55 20.245 -24.435 -2.601 1.00 21.44 C ATOM 788 C ASN A 55 19.726 -24.813 -1.217 1.00 22.35 C ATOM 789 O ASN A 55 19.990 -24.122 -0.234 1.00 2.45 O ATOM 790 CB ASN A 55 21.435 -25.323 -2.971 1.00 41.22 C ATOM 791 CG ASN A 55 22.192 -24.801 -4.178 1.00 33.25 C ATOM 792 OD1 ASN A 55 23.230 -24.155 -4.041 1.00 4.43 O ATOM 793 ND2 ASN A 55 21.673 -25.080 -5.367 1.00 74.54 N ATOM 0 H ASN A 55 21.636 -22.866 -2.630 1.00 21.22 H new ATOM 0 HA ASN A 55 19.445 -24.590 -3.325 1.00 21.44 H new ATOM 0 HB2 ASN A 55 22.114 -25.390 -2.121 1.00 41.22 H new ATOM 0 HB3 ASN A 55 21.081 -26.333 -3.176 1.00 41.22 H new ATOM 0 HD21 ASN A 55 22.137 -24.755 -6.215 1.00 74.54 H new ATOM 0 HD22 ASN A 55 20.810 -25.619 -5.433 1.00 74.54 H new ATOM 800 N MET A 56 18.987 -25.916 -1.148 1.00 42.23 N ATOM 801 CA MET A 56 18.433 -26.387 0.116 1.00 52.24 C ATOM 802 C MET A 56 18.979 -27.767 0.468 1.00 13.21 C ATOM 803 O MET A 56 18.257 -28.764 0.472 1.00 73.03 O ATOM 804 CB MET A 56 16.905 -26.433 0.041 1.00 24.43 C ATOM 805 CG MET A 56 16.242 -26.765 1.368 1.00 2.54 C ATOM 806 SD MET A 56 16.042 -25.317 2.425 1.00 75.22 S ATOM 807 CE MET A 56 14.451 -24.709 1.868 1.00 64.42 C ATOM 0 H MET A 56 18.758 -26.500 -1.952 1.00 42.23 H new ATOM 0 HA MET A 56 18.730 -25.688 0.898 1.00 52.24 H new ATOM 0 HB2 MET A 56 16.537 -25.468 -0.308 1.00 24.43 H new ATOM 0 HB3 MET A 56 16.608 -27.175 -0.700 1.00 24.43 H new ATOM 0 HG2 MET A 56 15.265 -27.211 1.180 1.00 2.54 H new ATOM 0 HG3 MET A 56 16.839 -27.512 1.891 1.00 2.54 H new ATOM 0 HE1 MET A 56 14.187 -23.813 2.429 1.00 64.42 H new ATOM 0 HE2 MET A 56 14.505 -24.469 0.806 1.00 64.42 H new ATOM 0 HE3 MET A 56 13.692 -25.475 2.029 1.00 64.42 H new ATOM 817 N PRO A 57 20.284 -27.828 0.771 1.00 32.24 N ATOM 818 CA PRO A 57 20.955 -29.081 1.131 1.00 11.10 C ATOM 819 C PRO A 57 20.513 -29.605 2.493 1.00 3.33 C ATOM 820 O PRO A 57 20.188 -30.783 2.640 1.00 22.01 O ATOM 821 CB PRO A 57 22.436 -28.694 1.161 1.00 34.12 C ATOM 822 CG PRO A 57 22.439 -27.232 1.444 1.00 4.55 C ATOM 823 CD PRO A 57 21.205 -26.679 0.787 1.00 32.33 C ATOM 0 HA PRO A 57 20.724 -29.883 0.430 1.00 11.10 H new ATOM 0 HB2 PRO A 57 22.974 -29.247 1.930 1.00 34.12 H new ATOM 0 HB3 PRO A 57 22.922 -28.914 0.211 1.00 34.12 H new ATOM 0 HG2 PRO A 57 22.428 -27.043 2.517 1.00 4.55 H new ATOM 0 HG3 PRO A 57 23.337 -26.760 1.047 1.00 4.55 H new ATOM 0 HD2 PRO A 57 20.792 -25.841 1.348 1.00 32.33 H new ATOM 0 HD3 PRO A 57 21.414 -26.317 -0.220 1.00 32.33 H new ATOM 831 N ARG A 58 20.504 -28.722 3.487 1.00 74.02 N ATOM 832 CA ARG A 58 20.102 -29.096 4.837 1.00 23.45 C ATOM 833 C ARG A 58 19.529 -27.897 5.586 1.00 12.04 C ATOM 834 O ARG A 58 19.389 -26.810 5.026 1.00 53.14 O ATOM 835 CB ARG A 58 21.295 -29.669 5.606 1.00 15.24 C ATOM 836 CG ARG A 58 21.670 -31.080 5.185 1.00 21.12 C ATOM 837 CD ARG A 58 22.800 -31.076 4.167 1.00 12.33 C ATOM 838 NE ARG A 58 23.773 -32.134 4.425 1.00 10.31 N ATOM 839 CZ ARG A 58 23.507 -33.427 4.282 1.00 64.32 C ATOM 840 NH1 ARG A 58 22.305 -33.821 3.884 1.00 2.45 N ATOM 841 NH2 ARG A 58 24.446 -34.331 4.536 1.00 53.43 N ATOM 0 H ARG A 58 20.771 -27.743 3.382 1.00 74.02 H new ATOM 0 HA ARG A 58 19.327 -29.858 4.760 1.00 23.45 H new ATOM 0 HB2 ARG A 58 22.156 -29.016 5.464 1.00 15.24 H new ATOM 0 HB3 ARG A 58 21.065 -29.666 6.671 1.00 15.24 H new ATOM 0 HG2 ARG A 58 21.970 -31.655 6.061 1.00 21.12 H new ATOM 0 HG3 ARG A 58 20.798 -31.578 4.761 1.00 21.12 H new ATOM 0 HD2 ARG A 58 22.387 -31.200 3.166 1.00 12.33 H new ATOM 0 HD3 ARG A 58 23.302 -30.109 4.187 1.00 12.33 H new ATOM 0 HE ARG A 58 24.708 -31.865 4.732 1.00 10.31 H new ATOM 0 HH11 ARG A 58 21.581 -33.130 3.687 1.00 2.45 H new ATOM 0 HH12 ARG A 58 22.104 -34.815 3.775 1.00 2.45 H new ATOM 0 HH21 ARG A 58 25.372 -34.032 4.841 1.00 53.43 H new ATOM 0 HH22 ARG A 58 24.241 -35.324 4.426 1.00 53.43 H new ATOM 855 N LYS A 59 19.198 -28.102 6.857 1.00 60.32 N ATOM 856 CA LYS A 59 18.640 -27.039 7.684 1.00 23.11 C ATOM 857 C LYS A 59 19.522 -25.795 7.639 1.00 61.21 C ATOM 858 O LYS A 59 20.655 -25.808 8.120 1.00 20.11 O ATOM 859 CB LYS A 59 18.488 -27.517 9.130 1.00 12.30 C ATOM 860 CG LYS A 59 17.282 -26.927 9.841 1.00 4.25 C ATOM 861 CD LYS A 59 16.997 -27.649 11.147 1.00 31.43 C ATOM 862 CE LYS A 59 15.585 -27.373 11.640 1.00 75.42 C ATOM 863 NZ LYS A 59 15.090 -28.453 12.538 1.00 14.23 N ATOM 0 H LYS A 59 19.307 -28.996 7.337 1.00 60.32 H new ATOM 0 HA LYS A 59 17.658 -26.781 7.287 1.00 23.11 H new ATOM 0 HB2 LYS A 59 18.408 -28.604 9.138 1.00 12.30 H new ATOM 0 HB3 LYS A 59 19.389 -27.259 9.686 1.00 12.30 H new ATOM 0 HG2 LYS A 59 17.457 -25.870 10.039 1.00 4.25 H new ATOM 0 HG3 LYS A 59 16.409 -26.990 9.191 1.00 4.25 H new ATOM 0 HD2 LYS A 59 17.132 -28.722 11.008 1.00 31.43 H new ATOM 0 HD3 LYS A 59 17.716 -27.333 11.903 1.00 31.43 H new ATOM 0 HE2 LYS A 59 15.565 -26.421 12.171 1.00 75.42 H new ATOM 0 HE3 LYS A 59 14.915 -27.275 10.786 1.00 75.42 H new ATOM 0 HZ1 LYS A 59 14.125 -28.228 12.853 1.00 14.23 H new ATOM 0 HZ2 LYS A 59 15.084 -29.357 12.024 1.00 14.23 H new ATOM 0 HZ3 LYS A 59 15.715 -28.530 13.366 1.00 14.23 H new ATOM 877 N SER A 60 18.994 -24.722 7.059 1.00 3.11 N ATOM 878 CA SER A 60 19.735 -23.470 6.949 1.00 34.44 C ATOM 879 C SER A 60 18.914 -22.304 7.492 1.00 71.40 C ATOM 880 O SER A 60 17.846 -22.499 8.071 1.00 50.51 O ATOM 881 CB SER A 60 20.117 -23.205 5.492 1.00 74.42 C ATOM 882 OG SER A 60 18.964 -23.069 4.679 1.00 32.41 O ATOM 0 H SER A 60 18.057 -24.694 6.658 1.00 3.11 H new ATOM 0 HA SER A 60 20.644 -23.560 7.544 1.00 34.44 H new ATOM 0 HB2 SER A 60 20.719 -22.298 5.430 1.00 74.42 H new ATOM 0 HB3 SER A 60 20.734 -24.023 5.120 1.00 74.42 H new ATOM 0 HG SER A 60 19.115 -23.515 3.820 1.00 32.41 H new ATOM 888 N GLY A 61 19.422 -21.091 7.300 1.00 43.23 N ATOM 889 CA GLY A 61 18.725 -19.910 7.775 1.00 33.52 C ATOM 890 C GLY A 61 17.407 -19.688 7.060 1.00 70.23 C ATOM 891 O GLY A 61 16.458 -19.160 7.641 1.00 52.04 O ATOM 0 H GLY A 61 20.304 -20.905 6.824 1.00 43.23 H new ATOM 0 HA2 GLY A 61 18.543 -20.005 8.845 1.00 33.52 H new ATOM 0 HA3 GLY A 61 19.362 -19.036 7.637 1.00 33.52 H new ATOM 895 N LEU A 62 17.347 -20.090 5.795 1.00 63.00 N ATOM 896 CA LEU A 62 16.136 -19.931 4.998 1.00 40.52 C ATOM 897 C LEU A 62 14.919 -20.472 5.742 1.00 44.13 C ATOM 898 O LEU A 62 13.807 -19.971 5.578 1.00 24.15 O ATOM 899 CB LEU A 62 16.288 -20.647 3.655 1.00 74.20 C ATOM 900 CG LEU A 62 16.706 -19.774 2.472 1.00 42.04 C ATOM 901 CD1 LEU A 62 15.576 -18.839 2.072 1.00 14.31 C ATOM 902 CD2 LEU A 62 17.961 -18.983 2.810 1.00 0.43 C ATOM 0 H LEU A 62 18.123 -20.529 5.299 1.00 63.00 H new ATOM 0 HA LEU A 62 15.985 -18.866 4.820 1.00 40.52 H new ATOM 0 HB2 LEU A 62 17.024 -21.442 3.772 1.00 74.20 H new ATOM 0 HB3 LEU A 62 15.339 -21.124 3.411 1.00 74.20 H new ATOM 0 HG LEU A 62 16.928 -20.425 1.626 1.00 42.04 H new ATOM 0 HD11 LEU A 62 15.893 -18.226 1.228 1.00 14.31 H new ATOM 0 HD12 LEU A 62 14.702 -19.425 1.787 1.00 14.31 H new ATOM 0 HD13 LEU A 62 15.322 -18.195 2.914 1.00 14.31 H new ATOM 0 HD21 LEU A 62 18.244 -18.367 1.956 1.00 0.43 H new ATOM 0 HD22 LEU A 62 17.767 -18.343 3.671 1.00 0.43 H new ATOM 0 HD23 LEU A 62 18.773 -19.671 3.046 1.00 0.43 H new ATOM 914 N GLU A 63 15.140 -21.496 6.560 1.00 31.10 N ATOM 915 CA GLU A 63 14.061 -22.104 7.330 1.00 51.21 C ATOM 916 C GLU A 63 13.271 -21.043 8.091 1.00 2.21 C ATOM 917 O GLU A 63 12.083 -21.215 8.366 1.00 31.21 O ATOM 918 CB GLU A 63 14.622 -23.137 8.309 1.00 62.43 C ATOM 919 CG GLU A 63 14.683 -24.545 7.739 1.00 0.31 C ATOM 920 CD GLU A 63 15.181 -24.574 6.307 1.00 15.50 C ATOM 921 OE1 GLU A 63 16.392 -24.800 6.103 1.00 15.24 O ATOM 922 OE2 GLU A 63 14.358 -24.370 5.390 1.00 52.13 O ATOM 0 H GLU A 63 16.055 -21.922 6.707 1.00 31.10 H new ATOM 0 HA GLU A 63 13.388 -22.603 6.632 1.00 51.21 H new ATOM 0 HB2 GLU A 63 15.624 -22.832 8.611 1.00 62.43 H new ATOM 0 HB3 GLU A 63 14.007 -23.144 9.209 1.00 62.43 H new ATOM 0 HG2 GLU A 63 15.338 -25.156 8.360 1.00 0.31 H new ATOM 0 HG3 GLU A 63 13.691 -24.994 7.784 1.00 0.31 H new ATOM 929 N LEU A 64 13.939 -19.946 8.429 1.00 5.31 N ATOM 930 CA LEU A 64 13.302 -18.856 9.159 1.00 14.33 C ATOM 931 C LEU A 64 11.986 -18.455 8.499 1.00 3.52 C ATOM 932 O LEU A 64 11.051 -18.019 9.171 1.00 0.41 O ATOM 933 CB LEU A 64 14.238 -17.648 9.233 1.00 73.14 C ATOM 934 CG LEU A 64 14.524 -16.940 7.908 1.00 2.42 C ATOM 935 CD1 LEU A 64 13.476 -15.871 7.637 1.00 63.43 C ATOM 936 CD2 LEU A 64 15.919 -16.331 7.920 1.00 13.50 C ATOM 0 H LEU A 64 14.922 -19.788 8.209 1.00 5.31 H new ATOM 0 HA LEU A 64 13.089 -19.204 10.170 1.00 14.33 H new ATOM 0 HB2 LEU A 64 13.809 -16.923 9.925 1.00 73.14 H new ATOM 0 HB3 LEU A 64 15.186 -17.974 9.660 1.00 73.14 H new ATOM 0 HG LEU A 64 14.477 -17.677 7.106 1.00 2.42 H new ATOM 0 HD11 LEU A 64 13.696 -15.378 6.690 1.00 63.43 H new ATOM 0 HD12 LEU A 64 12.490 -16.333 7.585 1.00 63.43 H new ATOM 0 HD13 LEU A 64 13.490 -15.135 8.441 1.00 63.43 H new ATOM 0 HD21 LEU A 64 16.106 -15.831 6.970 1.00 13.50 H new ATOM 0 HD22 LEU A 64 15.993 -15.607 8.731 1.00 13.50 H new ATOM 0 HD23 LEU A 64 16.658 -17.118 8.068 1.00 13.50 H new ATOM 948 N ILE A 65 11.921 -18.607 7.181 1.00 44.32 N ATOM 949 CA ILE A 65 10.720 -18.263 6.431 1.00 75.50 C ATOM 950 C ILE A 65 9.474 -18.842 7.094 1.00 10.41 C ATOM 951 O ILE A 65 8.408 -18.228 7.077 1.00 55.24 O ATOM 952 CB ILE A 65 10.797 -18.772 4.979 1.00 4.22 C ATOM 953 CG1 ILE A 65 11.979 -18.126 4.252 1.00 32.04 C ATOM 954 CG2 ILE A 65 9.496 -18.483 4.246 1.00 33.15 C ATOM 955 CD1 ILE A 65 12.471 -18.928 3.068 1.00 52.12 C ATOM 0 H ILE A 65 12.686 -18.966 6.610 1.00 44.32 H new ATOM 0 HA ILE A 65 10.654 -17.175 6.423 1.00 75.50 H new ATOM 0 HB ILE A 65 10.949 -19.851 4.995 1.00 4.22 H new ATOM 0 HG12 ILE A 65 11.687 -17.133 3.912 1.00 32.04 H new ATOM 0 HG13 ILE A 65 12.800 -17.993 4.957 1.00 32.04 H new ATOM 0 HG21 ILE A 65 9.567 -18.849 3.222 1.00 33.15 H new ATOM 0 HG22 ILE A 65 8.673 -18.985 4.755 1.00 33.15 H new ATOM 0 HG23 ILE A 65 9.315 -17.408 4.236 1.00 33.15 H new ATOM 0 HD11 ILE A 65 13.309 -18.411 2.601 1.00 52.12 H new ATOM 0 HD12 ILE A 65 12.795 -19.913 3.405 1.00 52.12 H new ATOM 0 HD13 ILE A 65 11.664 -19.039 2.343 1.00 52.12 H new ATOM 967 N ALA A 66 9.618 -20.026 7.680 1.00 52.21 N ATOM 968 CA ALA A 66 8.506 -20.685 8.353 1.00 75.44 C ATOM 969 C ALA A 66 7.817 -19.740 9.331 1.00 4.13 C ATOM 970 O ALA A 66 6.592 -19.630 9.345 1.00 33.22 O ATOM 971 CB ALA A 66 8.991 -21.934 9.074 1.00 12.24 C ATOM 0 H ALA A 66 10.494 -20.548 7.702 1.00 52.21 H new ATOM 0 HA ALA A 66 7.777 -20.976 7.597 1.00 75.44 H new ATOM 0 HB1 ALA A 66 8.150 -22.416 9.572 1.00 12.24 H new ATOM 0 HB2 ALA A 66 9.429 -22.624 8.352 1.00 12.24 H new ATOM 0 HB3 ALA A 66 9.742 -21.658 9.814 1.00 12.24 H new ATOM 977 N ALA A 67 8.614 -19.060 10.149 1.00 0.40 N ATOM 978 CA ALA A 67 8.081 -18.123 11.130 1.00 2.51 C ATOM 979 C ALA A 67 7.518 -16.879 10.452 1.00 54.44 C ATOM 980 O ALA A 67 6.534 -16.299 10.913 1.00 12.34 O ATOM 981 CB ALA A 67 9.160 -17.737 12.132 1.00 54.13 C ATOM 0 H ALA A 67 9.631 -19.141 10.152 1.00 0.40 H new ATOM 0 HA ALA A 67 7.266 -18.616 11.661 1.00 2.51 H new ATOM 0 HB1 ALA A 67 8.748 -17.037 12.859 1.00 54.13 H new ATOM 0 HB2 ALA A 67 9.513 -18.630 12.648 1.00 54.13 H new ATOM 0 HB3 ALA A 67 9.992 -17.268 11.608 1.00 54.13 H new ATOM 987 N LEU A 68 8.147 -16.473 9.354 1.00 13.22 N ATOM 988 CA LEU A 68 7.708 -15.296 8.612 1.00 60.13 C ATOM 989 C LEU A 68 6.272 -15.463 8.125 1.00 21.32 C ATOM 990 O LEU A 68 5.530 -14.489 8.004 1.00 51.41 O ATOM 991 CB LEU A 68 8.636 -15.045 7.422 1.00 53.42 C ATOM 992 CG LEU A 68 9.879 -14.201 7.706 1.00 13.24 C ATOM 993 CD1 LEU A 68 9.516 -12.726 7.785 1.00 42.11 C ATOM 994 CD2 LEU A 68 10.549 -14.656 8.994 1.00 22.42 C ATOM 0 H LEU A 68 8.962 -16.941 8.958 1.00 13.22 H new ATOM 0 HA LEU A 68 7.747 -14.438 9.283 1.00 60.13 H new ATOM 0 HB2 LEU A 68 8.958 -16.009 7.029 1.00 53.42 H new ATOM 0 HB3 LEU A 68 8.061 -14.556 6.636 1.00 53.42 H new ATOM 0 HG LEU A 68 10.583 -14.338 6.885 1.00 13.24 H new ATOM 0 HD11 LEU A 68 10.413 -12.141 7.988 1.00 42.11 H new ATOM 0 HD12 LEU A 68 9.081 -12.407 6.838 1.00 42.11 H new ATOM 0 HD13 LEU A 68 8.793 -12.572 8.586 1.00 42.11 H new ATOM 0 HD21 LEU A 68 11.432 -14.044 9.181 1.00 22.42 H new ATOM 0 HD22 LEU A 68 9.851 -14.549 9.825 1.00 22.42 H new ATOM 0 HD23 LEU A 68 10.845 -15.701 8.901 1.00 22.42 H new ATOM 1006 N ARG A 69 5.887 -16.705 7.850 1.00 32.12 N ATOM 1007 CA ARG A 69 4.539 -17.000 7.378 1.00 23.11 C ATOM 1008 C ARG A 69 3.549 -17.021 8.539 1.00 51.43 C ATOM 1009 O ARG A 69 2.393 -16.626 8.387 1.00 3.52 O ATOM 1010 CB ARG A 69 4.514 -18.345 6.649 1.00 44.54 C ATOM 1011 CG ARG A 69 3.424 -18.445 5.594 1.00 22.44 C ATOM 1012 CD ARG A 69 2.107 -18.908 6.197 1.00 22.44 C ATOM 1013 NE ARG A 69 1.279 -19.617 5.225 1.00 23.13 N ATOM 1014 CZ ARG A 69 0.195 -20.312 5.551 1.00 12.32 C ATOM 1015 NH1 ARG A 69 -0.191 -20.390 6.817 1.00 4.14 N ATOM 1016 NH2 ARG A 69 -0.507 -20.929 4.609 1.00 22.45 N ATOM 0 H ARG A 69 6.489 -17.523 7.946 1.00 32.12 H new ATOM 0 HA ARG A 69 4.243 -16.213 6.685 1.00 23.11 H new ATOM 0 HB2 ARG A 69 5.482 -18.511 6.176 1.00 44.54 H new ATOM 0 HB3 ARG A 69 4.375 -19.142 7.379 1.00 44.54 H new ATOM 0 HG2 ARG A 69 3.286 -17.474 5.118 1.00 22.44 H new ATOM 0 HG3 ARG A 69 3.733 -19.141 4.814 1.00 22.44 H new ATOM 0 HD2 ARG A 69 2.307 -19.560 7.047 1.00 22.44 H new ATOM 0 HD3 ARG A 69 1.560 -18.046 6.579 1.00 22.44 H new ATOM 0 HE ARG A 69 1.548 -19.576 4.242 1.00 23.13 H new ATOM 0 HH11 ARG A 69 0.345 -19.916 7.544 1.00 4.14 H new ATOM 0 HH12 ARG A 69 -1.024 -20.924 7.064 1.00 4.14 H new ATOM 0 HH21 ARG A 69 -0.214 -20.870 3.634 1.00 22.45 H new ATOM 0 HH22 ARG A 69 -1.339 -21.462 4.860 1.00 22.45 H new ATOM 1030 N GLN A 70 4.011 -17.484 9.696 1.00 75.13 N ATOM 1031 CA GLN A 70 3.165 -17.557 10.881 1.00 55.00 C ATOM 1032 C GLN A 70 3.316 -16.303 11.736 1.00 54.14 C ATOM 1033 O GLN A 70 3.081 -16.331 12.945 1.00 51.45 O ATOM 1034 CB GLN A 70 3.513 -18.796 11.707 1.00 63.41 C ATOM 1035 CG GLN A 70 4.770 -18.634 12.546 1.00 25.30 C ATOM 1036 CD GLN A 70 5.476 -19.952 12.800 1.00 3.42 C ATOM 1037 OE1 GLN A 70 5.774 -20.299 13.943 1.00 30.24 O ATOM 1038 NE2 GLN A 70 5.748 -20.693 11.733 1.00 62.41 N ATOM 0 H GLN A 70 4.966 -17.814 9.838 1.00 75.13 H new ATOM 0 HA GLN A 70 2.128 -17.628 10.552 1.00 55.00 H new ATOM 0 HB2 GLN A 70 2.676 -19.032 12.364 1.00 63.41 H new ATOM 0 HB3 GLN A 70 3.641 -19.646 11.036 1.00 63.41 H new ATOM 0 HG2 GLN A 70 5.454 -17.951 12.041 1.00 25.30 H new ATOM 0 HG3 GLN A 70 4.509 -18.176 13.500 1.00 25.30 H new ATOM 0 HE21 GLN A 70 5.483 -20.366 10.804 1.00 62.41 H new ATOM 0 HE22 GLN A 70 6.222 -21.589 11.842 1.00 62.41 H new ATOM 1047 N LEU A 71 3.709 -15.204 11.101 1.00 70.33 N ATOM 1048 CA LEU A 71 3.892 -13.939 11.803 1.00 51.21 C ATOM 1049 C LEU A 71 2.700 -13.014 11.579 1.00 74.32 C ATOM 1050 O LEU A 71 2.493 -12.059 12.327 1.00 42.55 O ATOM 1051 CB LEU A 71 5.177 -13.254 11.335 1.00 65.50 C ATOM 1052 CG LEU A 71 6.187 -12.903 12.428 1.00 12.43 C ATOM 1053 CD1 LEU A 71 5.582 -11.917 13.416 1.00 20.00 C ATOM 1054 CD2 LEU A 71 6.656 -14.160 13.146 1.00 14.00 C ATOM 0 H LEU A 71 3.907 -15.164 10.101 1.00 70.33 H new ATOM 0 HA LEU A 71 3.968 -14.152 12.869 1.00 51.21 H new ATOM 0 HB2 LEU A 71 5.668 -13.903 10.610 1.00 65.50 H new ATOM 0 HB3 LEU A 71 4.906 -12.338 10.811 1.00 65.50 H new ATOM 0 HG LEU A 71 7.052 -12.433 11.959 1.00 12.43 H new ATOM 0 HD11 LEU A 71 6.315 -11.678 14.187 1.00 20.00 H new ATOM 0 HD12 LEU A 71 5.297 -11.005 12.892 1.00 20.00 H new ATOM 0 HD13 LEU A 71 4.700 -12.360 13.878 1.00 20.00 H new ATOM 0 HD21 LEU A 71 7.374 -13.890 13.920 1.00 14.00 H new ATOM 0 HD22 LEU A 71 5.801 -14.659 13.602 1.00 14.00 H new ATOM 0 HD23 LEU A 71 7.129 -14.833 12.431 1.00 14.00 H new ATOM 1066 N SER A 72 1.916 -13.307 10.546 1.00 63.15 N ATOM 1067 CA SER A 72 0.745 -12.501 10.222 1.00 71.32 C ATOM 1068 C SER A 72 1.152 -11.084 9.829 1.00 30.25 C ATOM 1069 O SER A 72 0.401 -10.131 10.036 1.00 21.32 O ATOM 1070 CB SER A 72 -0.215 -12.457 11.412 1.00 21.23 C ATOM 1071 OG SER A 72 -1.490 -11.979 11.022 1.00 53.22 O ATOM 0 H SER A 72 2.071 -14.097 9.919 1.00 63.15 H new ATOM 0 HA SER A 72 0.240 -12.963 9.374 1.00 71.32 H new ATOM 0 HB2 SER A 72 -0.313 -13.454 11.841 1.00 21.23 H new ATOM 0 HB3 SER A 72 0.195 -11.814 12.190 1.00 21.23 H new ATOM 0 HG SER A 72 -1.387 -11.143 10.520 1.00 53.22 H new ATOM 1077 N ALA A 73 2.347 -10.954 9.262 1.00 33.21 N ATOM 1078 CA ALA A 73 2.854 -9.655 8.839 1.00 50.14 C ATOM 1079 C ALA A 73 3.591 -9.761 7.508 1.00 53.53 C ATOM 1080 O ALA A 73 3.543 -8.845 6.686 1.00 13.31 O ATOM 1081 CB ALA A 73 3.769 -9.072 9.906 1.00 73.23 C ATOM 0 H ALA A 73 2.982 -11.733 9.085 1.00 33.21 H new ATOM 0 HA ALA A 73 2.003 -8.988 8.702 1.00 50.14 H new ATOM 0 HB1 ALA A 73 4.140 -8.102 9.576 1.00 73.23 H new ATOM 0 HB2 ALA A 73 3.213 -8.951 10.836 1.00 73.23 H new ATOM 0 HB3 ALA A 73 4.610 -9.745 10.071 1.00 73.23 H new ATOM 1087 N TYR A 74 4.272 -10.882 7.302 1.00 41.15 N ATOM 1088 CA TYR A 74 5.022 -11.105 6.071 1.00 31.51 C ATOM 1089 C TYR A 74 4.382 -12.211 5.237 1.00 64.13 C ATOM 1090 O TYR A 74 4.587 -12.287 4.026 1.00 61.43 O ATOM 1091 CB TYR A 74 6.473 -11.468 6.392 1.00 51.20 C ATOM 1092 CG TYR A 74 7.045 -10.699 7.561 1.00 14.44 C ATOM 1093 CD1 TYR A 74 6.791 -11.095 8.869 1.00 4.30 C ATOM 1094 CD2 TYR A 74 7.837 -9.575 7.359 1.00 20.52 C ATOM 1095 CE1 TYR A 74 7.311 -10.395 9.941 1.00 50.22 C ATOM 1096 CE2 TYR A 74 8.362 -8.870 8.425 1.00 60.33 C ATOM 1097 CZ TYR A 74 8.096 -9.284 9.713 1.00 0.35 C ATOM 1098 OH TYR A 74 8.616 -8.583 10.778 1.00 70.13 O ATOM 0 H TYR A 74 4.321 -11.651 7.971 1.00 41.15 H new ATOM 0 HA TYR A 74 5.005 -10.182 5.492 1.00 31.51 H new ATOM 0 HB2 TYR A 74 6.533 -12.535 6.606 1.00 51.20 H new ATOM 0 HB3 TYR A 74 7.088 -11.284 5.511 1.00 51.20 H new ATOM 0 HD1 TYR A 74 6.177 -11.965 9.051 1.00 4.30 H new ATOM 0 HD2 TYR A 74 8.046 -9.247 6.351 1.00 20.52 H new ATOM 0 HE1 TYR A 74 7.104 -10.716 10.951 1.00 50.22 H new ATOM 0 HE2 TYR A 74 8.977 -8.000 8.250 1.00 60.33 H new ATOM 0 HH TYR A 74 9.417 -8.097 10.490 1.00 70.13 H new ATOM 1108 N ALA A 75 3.606 -13.066 5.895 1.00 62.04 N ATOM 1109 CA ALA A 75 2.934 -14.166 5.215 1.00 72.22 C ATOM 1110 C ALA A 75 2.227 -13.682 3.954 1.00 74.14 C ATOM 1111 O ALA A 75 2.243 -14.356 2.924 1.00 61.24 O ATOM 1112 CB ALA A 75 1.943 -14.839 6.153 1.00 73.33 C ATOM 0 H ALA A 75 3.427 -13.018 6.898 1.00 62.04 H new ATOM 0 HA ALA A 75 3.690 -14.894 4.919 1.00 72.22 H new ATOM 0 HB1 ALA A 75 1.448 -15.659 5.632 1.00 73.33 H new ATOM 0 HB2 ALA A 75 2.472 -15.228 7.023 1.00 73.33 H new ATOM 0 HB3 ALA A 75 1.198 -14.113 6.477 1.00 73.33 H new ATOM 1118 N ASP A 76 1.606 -12.511 4.042 1.00 52.12 N ATOM 1119 CA ASP A 76 0.893 -11.936 2.907 1.00 35.30 C ATOM 1120 C ASP A 76 1.868 -11.336 1.899 1.00 21.43 C ATOM 1121 O ASP A 76 1.628 -11.367 0.692 1.00 61.03 O ATOM 1122 CB ASP A 76 -0.090 -10.866 3.384 1.00 1.51 C ATOM 1123 CG ASP A 76 -1.147 -10.545 2.345 1.00 24.22 C ATOM 1124 OD1 ASP A 76 -2.329 -10.872 2.580 1.00 22.53 O ATOM 1125 OD2 ASP A 76 -0.791 -9.966 1.297 1.00 35.53 O ATOM 0 H ASP A 76 1.582 -11.941 4.888 1.00 52.12 H new ATOM 0 HA ASP A 76 0.338 -12.735 2.416 1.00 35.30 H new ATOM 0 HB2 ASP A 76 -0.576 -11.205 4.299 1.00 1.51 H new ATOM 0 HB3 ASP A 76 0.459 -9.958 3.632 1.00 1.51 H new ATOM 1130 N THR A 77 2.970 -10.790 2.403 1.00 2.42 N ATOM 1131 CA THR A 77 3.981 -10.181 1.548 1.00 0.51 C ATOM 1132 C THR A 77 4.393 -11.126 0.425 1.00 4.44 C ATOM 1133 O THR A 77 4.654 -12.309 0.642 1.00 60.21 O ATOM 1134 CB THR A 77 5.232 -9.782 2.354 1.00 50.34 C ATOM 1135 OG1 THR A 77 4.860 -8.943 3.453 1.00 50.11 O ATOM 1136 CG2 THR A 77 6.235 -9.054 1.471 1.00 72.23 C ATOM 0 H THR A 77 3.185 -10.757 3.400 1.00 2.42 H new ATOM 0 HA THR A 77 3.534 -9.285 1.119 1.00 0.51 H new ATOM 0 HB THR A 77 5.698 -10.691 2.733 1.00 50.34 H new ATOM 0 HG1 THR A 77 5.661 -8.695 3.961 1.00 50.11 H new ATOM 0 HG21 THR A 77 7.110 -8.782 2.062 1.00 72.23 H new ATOM 0 HG22 THR A 77 6.539 -9.706 0.652 1.00 72.23 H new ATOM 0 HG23 THR A 77 5.776 -8.152 1.066 1.00 72.23 H new ATOM 1144 N PRO A 78 4.456 -10.593 -0.804 1.00 75.43 N ATOM 1145 CA PRO A 78 4.837 -11.373 -1.986 1.00 4.43 C ATOM 1146 C PRO A 78 6.312 -11.760 -1.973 1.00 20.44 C ATOM 1147 O PRO A 78 7.190 -10.903 -2.079 1.00 33.22 O ATOM 1148 CB PRO A 78 4.545 -10.421 -3.148 1.00 41.42 C ATOM 1149 CG PRO A 78 4.639 -9.058 -2.554 1.00 43.44 C ATOM 1150 CD PRO A 78 4.158 -9.190 -1.136 1.00 3.22 C ATOM 0 HA PRO A 78 4.295 -12.317 -2.044 1.00 4.43 H new ATOM 0 HB2 PRO A 78 5.264 -10.551 -3.957 1.00 41.42 H new ATOM 0 HB3 PRO A 78 3.556 -10.602 -3.569 1.00 41.42 H new ATOM 0 HG2 PRO A 78 5.664 -8.688 -2.586 1.00 43.44 H new ATOM 0 HG3 PRO A 78 4.027 -8.347 -3.109 1.00 43.44 H new ATOM 0 HD2 PRO A 78 4.677 -8.501 -0.470 1.00 3.22 H new ATOM 0 HD3 PRO A 78 3.093 -8.974 -1.051 1.00 3.22 H new ATOM 1158 N ILE A 79 6.577 -13.056 -1.842 1.00 42.13 N ATOM 1159 CA ILE A 79 7.946 -13.556 -1.817 1.00 60.11 C ATOM 1160 C ILE A 79 8.243 -14.406 -3.048 1.00 5.11 C ATOM 1161 O ILE A 79 7.461 -15.284 -3.413 1.00 61.34 O ATOM 1162 CB ILE A 79 8.217 -14.392 -0.552 1.00 73.23 C ATOM 1163 CG1 ILE A 79 7.991 -13.546 0.703 1.00 71.44 C ATOM 1164 CG2 ILE A 79 9.634 -14.946 -0.577 1.00 15.14 C ATOM 1165 CD1 ILE A 79 8.970 -12.402 0.845 1.00 64.45 C ATOM 0 H ILE A 79 5.862 -13.778 -1.752 1.00 42.13 H new ATOM 0 HA ILE A 79 8.601 -12.684 -1.814 1.00 60.11 H new ATOM 0 HB ILE A 79 7.521 -15.230 -0.532 1.00 73.23 H new ATOM 0 HG12 ILE A 79 6.977 -13.146 0.684 1.00 71.44 H new ATOM 0 HG13 ILE A 79 8.064 -14.187 1.581 1.00 71.44 H new ATOM 0 HG21 ILE A 79 9.811 -15.534 0.323 1.00 15.14 H new ATOM 0 HG22 ILE A 79 9.762 -15.579 -1.455 1.00 15.14 H new ATOM 0 HG23 ILE A 79 10.346 -14.122 -0.617 1.00 15.14 H new ATOM 0 HD11 ILE A 79 8.750 -11.846 1.756 1.00 64.45 H new ATOM 0 HD12 ILE A 79 9.985 -12.796 0.896 1.00 64.45 H new ATOM 0 HD13 ILE A 79 8.881 -11.738 -0.015 1.00 64.45 H new ATOM 1177 N LEU A 80 9.380 -14.140 -3.683 1.00 33.22 N ATOM 1178 CA LEU A 80 9.783 -14.882 -4.873 1.00 12.15 C ATOM 1179 C LEU A 80 11.154 -15.521 -4.677 1.00 71.21 C ATOM 1180 O LEU A 80 12.151 -14.828 -4.476 1.00 10.31 O ATOM 1181 CB LEU A 80 9.808 -13.956 -6.090 1.00 71.53 C ATOM 1182 CG LEU A 80 8.495 -13.246 -6.421 1.00 33.14 C ATOM 1183 CD1 LEU A 80 7.321 -14.204 -6.285 1.00 0.42 C ATOM 1184 CD2 LEU A 80 8.303 -12.034 -5.521 1.00 2.21 C ATOM 0 H LEU A 80 10.038 -13.417 -3.394 1.00 33.22 H new ATOM 0 HA LEU A 80 9.054 -15.675 -5.042 1.00 12.15 H new ATOM 0 HB2 LEU A 80 10.576 -13.200 -5.930 1.00 71.53 H new ATOM 0 HB3 LEU A 80 10.111 -14.540 -6.959 1.00 71.53 H new ATOM 0 HG LEU A 80 8.540 -12.903 -7.455 1.00 33.14 H new ATOM 0 HD11 LEU A 80 6.395 -13.681 -6.524 1.00 0.42 H new ATOM 0 HD12 LEU A 80 7.453 -15.041 -6.971 1.00 0.42 H new ATOM 0 HD13 LEU A 80 7.273 -14.577 -5.262 1.00 0.42 H new ATOM 0 HD21 LEU A 80 7.364 -11.541 -5.770 1.00 2.21 H new ATOM 0 HD22 LEU A 80 8.279 -12.354 -4.479 1.00 2.21 H new ATOM 0 HD23 LEU A 80 9.129 -11.338 -5.668 1.00 2.21 H new ATOM 1196 N VAL A 81 11.197 -16.848 -4.740 1.00 33.32 N ATOM 1197 CA VAL A 81 12.446 -17.582 -4.573 1.00 52.42 C ATOM 1198 C VAL A 81 12.965 -18.094 -5.912 1.00 32.42 C ATOM 1199 O VAL A 81 12.212 -18.659 -6.707 1.00 24.53 O ATOM 1200 CB VAL A 81 12.274 -18.772 -3.612 1.00 34.45 C ATOM 1201 CG1 VAL A 81 11.290 -19.782 -4.183 1.00 21.32 C ATOM 1202 CG2 VAL A 81 13.618 -19.426 -3.328 1.00 35.21 C ATOM 0 H VAL A 81 10.381 -17.437 -4.906 1.00 33.32 H new ATOM 0 HA VAL A 81 13.169 -16.885 -4.149 1.00 52.42 H new ATOM 0 HB VAL A 81 11.870 -18.401 -2.670 1.00 34.45 H new ATOM 0 HG11 VAL A 81 11.181 -20.616 -3.490 1.00 21.32 H new ATOM 0 HG12 VAL A 81 10.322 -19.304 -4.330 1.00 21.32 H new ATOM 0 HG13 VAL A 81 11.661 -20.151 -5.139 1.00 21.32 H new ATOM 0 HG21 VAL A 81 13.478 -20.265 -2.647 1.00 35.21 H new ATOM 0 HG22 VAL A 81 14.053 -19.785 -4.261 1.00 35.21 H new ATOM 0 HG23 VAL A 81 14.288 -18.697 -2.872 1.00 35.21 H new ATOM 1212 N LEU A 82 14.255 -17.894 -6.155 1.00 63.44 N ATOM 1213 CA LEU A 82 14.877 -18.337 -7.399 1.00 33.23 C ATOM 1214 C LEU A 82 15.291 -19.802 -7.309 1.00 31.53 C ATOM 1215 O LEU A 82 15.620 -20.302 -6.232 1.00 15.41 O ATOM 1216 CB LEU A 82 16.095 -17.470 -7.720 1.00 41.11 C ATOM 1217 CG LEU A 82 15.799 -16.061 -8.234 1.00 51.42 C ATOM 1218 CD1 LEU A 82 16.848 -15.079 -7.736 1.00 21.02 C ATOM 1219 CD2 LEU A 82 15.735 -16.050 -9.755 1.00 5.14 C ATOM 0 H LEU A 82 14.891 -17.428 -5.508 1.00 63.44 H new ATOM 0 HA LEU A 82 14.144 -18.234 -8.199 1.00 33.23 H new ATOM 0 HB2 LEU A 82 16.704 -17.386 -6.820 1.00 41.11 H new ATOM 0 HB3 LEU A 82 16.698 -17.988 -8.466 1.00 41.11 H new ATOM 0 HG LEU A 82 14.828 -15.751 -7.847 1.00 51.42 H new ATOM 0 HD11 LEU A 82 16.620 -14.082 -8.112 1.00 21.02 H new ATOM 0 HD12 LEU A 82 16.845 -15.065 -6.646 1.00 21.02 H new ATOM 0 HD13 LEU A 82 17.831 -15.385 -8.092 1.00 21.02 H new ATOM 0 HD21 LEU A 82 15.523 -15.039 -10.103 1.00 5.14 H new ATOM 0 HD22 LEU A 82 16.690 -16.381 -10.162 1.00 5.14 H new ATOM 0 HD23 LEU A 82 14.945 -16.722 -10.091 1.00 5.14 H new ATOM 1231 N THR A 83 15.275 -20.488 -8.448 1.00 1.21 N ATOM 1232 CA THR A 83 15.650 -21.895 -8.498 1.00 72.34 C ATOM 1233 C THR A 83 16.735 -22.138 -9.541 1.00 74.44 C ATOM 1234 O THR A 83 16.726 -21.534 -10.615 1.00 31.44 O ATOM 1235 CB THR A 83 14.436 -22.789 -8.818 1.00 44.54 C ATOM 1236 OG1 THR A 83 14.874 -24.115 -9.134 1.00 42.22 O ATOM 1237 CG2 THR A 83 13.639 -22.221 -9.983 1.00 62.32 C ATOM 0 H THR A 83 15.006 -20.091 -9.348 1.00 1.21 H new ATOM 0 HA THR A 83 16.034 -22.155 -7.511 1.00 72.34 H new ATOM 0 HB THR A 83 13.793 -22.820 -7.939 1.00 44.54 H new ATOM 0 HG1 THR A 83 14.616 -24.725 -8.412 1.00 42.22 H new ATOM 0 HG21 THR A 83 12.787 -22.868 -10.191 1.00 62.32 H new ATOM 0 HG22 THR A 83 13.283 -21.223 -9.728 1.00 62.32 H new ATOM 0 HG23 THR A 83 14.276 -22.164 -10.866 1.00 62.32 H new ATOM 1245 N THR A 84 17.669 -23.028 -9.220 1.00 43.34 N ATOM 1246 CA THR A 84 18.762 -23.351 -10.130 1.00 14.54 C ATOM 1247 C THR A 84 18.236 -23.712 -11.514 1.00 71.10 C ATOM 1248 O THR A 84 18.554 -23.049 -12.501 1.00 31.33 O ATOM 1249 CB THR A 84 19.611 -24.518 -9.594 1.00 64.45 C ATOM 1250 OG1 THR A 84 18.768 -25.629 -9.269 1.00 2.02 O ATOM 1251 CG2 THR A 84 20.399 -24.095 -8.364 1.00 30.13 C ATOM 0 H THR A 84 17.691 -23.538 -8.337 1.00 43.34 H new ATOM 0 HA THR A 84 19.387 -22.461 -10.204 1.00 14.54 H new ATOM 0 HB THR A 84 20.315 -24.813 -10.372 1.00 64.45 H new ATOM 0 HG1 THR A 84 19.316 -26.367 -8.930 1.00 2.02 H new ATOM 0 HG21 THR A 84 20.991 -24.937 -8.004 1.00 30.13 H new ATOM 0 HG22 THR A 84 21.062 -23.269 -8.623 1.00 30.13 H new ATOM 0 HG23 THR A 84 19.710 -23.775 -7.582 1.00 30.13 H new ATOM 1259 N GLU A 85 17.429 -24.767 -11.579 1.00 4.00 N ATOM 1260 CA GLU A 85 16.860 -25.216 -12.844 1.00 41.32 C ATOM 1261 C GLU A 85 15.337 -25.118 -12.821 1.00 24.03 C ATOM 1262 O GLU A 85 14.725 -24.575 -13.739 1.00 70.43 O ATOM 1263 CB GLU A 85 17.285 -26.656 -13.138 1.00 42.20 C ATOM 1264 CG GLU A 85 17.104 -27.597 -11.959 1.00 10.43 C ATOM 1265 CD GLU A 85 17.706 -28.966 -12.207 1.00 74.22 C ATOM 1266 OE1 GLU A 85 16.966 -29.967 -12.100 1.00 12.24 O ATOM 1267 OE2 GLU A 85 18.915 -29.038 -12.509 1.00 1.32 O ATOM 0 H GLU A 85 17.155 -25.326 -10.771 1.00 4.00 H new ATOM 0 HA GLU A 85 17.237 -24.566 -13.633 1.00 41.32 H new ATOM 0 HB2 GLU A 85 16.708 -27.031 -13.983 1.00 42.20 H new ATOM 0 HB3 GLU A 85 18.332 -26.662 -13.440 1.00 42.20 H new ATOM 0 HG2 GLU A 85 17.564 -27.157 -11.074 1.00 10.43 H new ATOM 0 HG3 GLU A 85 16.041 -27.705 -11.745 1.00 10.43 H new ATOM 1274 N GLY A 86 14.732 -25.649 -11.762 1.00 43.23 N ATOM 1275 CA GLY A 86 13.287 -25.612 -11.638 1.00 72.23 C ATOM 1276 C GLY A 86 12.684 -26.993 -11.470 1.00 3.14 C ATOM 1277 O GLY A 86 11.746 -27.359 -12.177 1.00 14.41 O ATOM 0 H GLY A 86 15.217 -26.104 -10.989 1.00 43.23 H new ATOM 0 HA2 GLY A 86 13.015 -24.993 -10.783 1.00 72.23 H new ATOM 0 HA3 GLY A 86 12.861 -25.138 -12.523 1.00 72.23 H new ATOM 1281 N SER A 87 13.226 -27.763 -10.531 1.00 12.51 N ATOM 1282 CA SER A 87 12.739 -29.113 -10.275 1.00 61.22 C ATOM 1283 C SER A 87 11.366 -29.079 -9.611 1.00 22.23 C ATOM 1284 O SER A 87 11.056 -28.164 -8.848 1.00 53.44 O ATOM 1285 CB SER A 87 13.728 -29.875 -9.391 1.00 33.25 C ATOM 1286 OG SER A 87 14.863 -29.081 -9.094 1.00 22.35 O ATOM 0 H SER A 87 14.002 -27.475 -9.935 1.00 12.51 H new ATOM 0 HA SER A 87 12.647 -29.627 -11.232 1.00 61.22 H new ATOM 0 HB2 SER A 87 13.237 -30.174 -8.465 1.00 33.25 H new ATOM 0 HB3 SER A 87 14.042 -30.789 -9.895 1.00 33.25 H new ATOM 0 HG SER A 87 15.479 -29.590 -8.527 1.00 22.35 H new ATOM 1292 N ASP A 88 10.548 -30.084 -9.906 1.00 3.52 N ATOM 1293 CA ASP A 88 9.208 -30.171 -9.337 1.00 43.32 C ATOM 1294 C ASP A 88 9.271 -30.331 -7.821 1.00 74.04 C ATOM 1295 O ASP A 88 8.435 -29.793 -7.096 1.00 3.34 O ATOM 1296 CB ASP A 88 8.444 -31.342 -9.955 1.00 70.44 C ATOM 1297 CG ASP A 88 8.409 -31.276 -11.470 1.00 34.14 C ATOM 1298 OD1 ASP A 88 8.039 -30.212 -12.009 1.00 4.42 O ATOM 1299 OD2 ASP A 88 8.751 -32.288 -12.115 1.00 71.35 O ATOM 0 H ASP A 88 10.789 -30.849 -10.536 1.00 3.52 H new ATOM 0 HA ASP A 88 8.682 -29.244 -9.565 1.00 43.32 H new ATOM 0 HB2 ASP A 88 8.908 -32.278 -9.646 1.00 70.44 H new ATOM 0 HB3 ASP A 88 7.424 -31.350 -9.571 1.00 70.44 H new ATOM 1304 N ALA A 89 10.266 -31.076 -7.351 1.00 14.23 N ATOM 1305 CA ALA A 89 10.437 -31.306 -5.922 1.00 23.33 C ATOM 1306 C ALA A 89 10.677 -29.996 -5.179 1.00 64.13 C ATOM 1307 O ALA A 89 10.224 -29.820 -4.048 1.00 42.22 O ATOM 1308 CB ALA A 89 11.587 -32.272 -5.677 1.00 64.14 C ATOM 0 H ALA A 89 10.965 -31.530 -7.939 1.00 14.23 H new ATOM 0 HA ALA A 89 9.517 -31.747 -5.538 1.00 23.33 H new ATOM 0 HB1 ALA A 89 11.703 -32.435 -4.606 1.00 64.14 H new ATOM 0 HB2 ALA A 89 11.375 -33.222 -6.167 1.00 64.14 H new ATOM 0 HB3 ALA A 89 12.508 -31.852 -6.082 1.00 64.14 H new ATOM 1314 N PHE A 90 11.394 -29.080 -5.822 1.00 55.32 N ATOM 1315 CA PHE A 90 11.695 -27.786 -5.222 1.00 4.44 C ATOM 1316 C PHE A 90 10.413 -27.024 -4.898 1.00 44.23 C ATOM 1317 O PHE A 90 10.331 -26.324 -3.889 1.00 32.25 O ATOM 1318 CB PHE A 90 12.572 -26.955 -6.161 1.00 61.45 C ATOM 1319 CG PHE A 90 13.210 -25.770 -5.495 1.00 60.02 C ATOM 1320 CD1 PHE A 90 12.454 -24.660 -5.155 1.00 51.11 C ATOM 1321 CD2 PHE A 90 14.566 -25.766 -5.209 1.00 34.14 C ATOM 1322 CE1 PHE A 90 13.039 -23.568 -4.543 1.00 13.42 C ATOM 1323 CE2 PHE A 90 15.156 -24.677 -4.596 1.00 11.31 C ATOM 1324 CZ PHE A 90 14.391 -23.576 -4.262 1.00 30.54 C ATOM 0 H PHE A 90 11.777 -29.210 -6.758 1.00 55.32 H new ATOM 0 HA PHE A 90 12.236 -27.963 -4.293 1.00 4.44 H new ATOM 0 HB2 PHE A 90 13.353 -27.593 -6.575 1.00 61.45 H new ATOM 0 HB3 PHE A 90 11.967 -26.608 -6.998 1.00 61.45 H new ATOM 0 HD1 PHE A 90 11.396 -24.648 -5.371 1.00 51.11 H new ATOM 0 HD2 PHE A 90 15.169 -26.624 -5.468 1.00 34.14 H new ATOM 0 HE1 PHE A 90 12.439 -22.708 -4.284 1.00 13.42 H new ATOM 0 HE2 PHE A 90 16.214 -24.687 -4.378 1.00 11.31 H new ATOM 0 HZ PHE A 90 14.849 -22.724 -3.782 1.00 30.54 H new ATOM 1334 N LYS A 91 9.415 -27.164 -5.763 1.00 72.24 N ATOM 1335 CA LYS A 91 8.136 -26.491 -5.572 1.00 34.10 C ATOM 1336 C LYS A 91 7.583 -26.761 -4.176 1.00 54.52 C ATOM 1337 O LYS A 91 6.981 -25.884 -3.557 1.00 0.32 O ATOM 1338 CB LYS A 91 7.130 -26.953 -6.629 1.00 33.03 C ATOM 1339 CG LYS A 91 7.513 -26.561 -8.045 1.00 73.43 C ATOM 1340 CD LYS A 91 6.305 -26.554 -8.968 1.00 1.14 C ATOM 1341 CE LYS A 91 6.665 -26.040 -10.353 1.00 40.40 C ATOM 1342 NZ LYS A 91 7.568 -26.978 -11.076 1.00 13.13 N ATOM 0 H LYS A 91 9.467 -27.738 -6.604 1.00 72.24 H new ATOM 0 HA LYS A 91 8.298 -25.418 -5.679 1.00 34.10 H new ATOM 0 HB2 LYS A 91 7.031 -28.037 -6.575 1.00 33.03 H new ATOM 0 HB3 LYS A 91 6.152 -26.532 -6.396 1.00 33.03 H new ATOM 0 HG2 LYS A 91 7.973 -25.573 -8.038 1.00 73.43 H new ATOM 0 HG3 LYS A 91 8.260 -27.257 -8.427 1.00 73.43 H new ATOM 0 HD2 LYS A 91 5.900 -27.563 -9.047 1.00 1.14 H new ATOM 0 HD3 LYS A 91 5.522 -25.929 -8.539 1.00 1.14 H new ATOM 0 HE2 LYS A 91 5.754 -25.893 -10.934 1.00 40.40 H new ATOM 0 HE3 LYS A 91 7.148 -25.067 -10.265 1.00 40.40 H new ATOM 0 HZ1 LYS A 91 7.735 -26.625 -12.040 1.00 13.13 H new ATOM 0 HZ2 LYS A 91 8.474 -27.047 -10.570 1.00 13.13 H new ATOM 0 HZ3 LYS A 91 7.126 -27.918 -11.123 1.00 13.13 H new ATOM 1356 N ALA A 92 7.792 -27.978 -3.687 1.00 34.33 N ATOM 1357 CA ALA A 92 7.317 -28.361 -2.363 1.00 20.32 C ATOM 1358 C ALA A 92 8.103 -27.646 -1.270 1.00 23.05 C ATOM 1359 O ALA A 92 7.552 -27.287 -0.229 1.00 43.25 O ATOM 1360 CB ALA A 92 7.413 -29.869 -2.184 1.00 34.32 C ATOM 0 H ALA A 92 8.287 -28.716 -4.187 1.00 34.33 H new ATOM 0 HA ALA A 92 6.272 -28.062 -2.278 1.00 20.32 H new ATOM 0 HB1 ALA A 92 7.055 -30.141 -1.191 1.00 34.32 H new ATOM 0 HB2 ALA A 92 6.802 -30.365 -2.938 1.00 34.32 H new ATOM 0 HB3 ALA A 92 8.451 -30.183 -2.294 1.00 34.32 H new ATOM 1366 N ALA A 93 9.394 -27.443 -1.512 1.00 22.12 N ATOM 1367 CA ALA A 93 10.256 -26.769 -0.548 1.00 74.51 C ATOM 1368 C ALA A 93 9.824 -25.321 -0.344 1.00 62.14 C ATOM 1369 O ALA A 93 9.483 -24.916 0.766 1.00 12.42 O ATOM 1370 CB ALA A 93 11.706 -26.831 -1.003 1.00 61.14 C ATOM 0 H ALA A 93 9.866 -27.736 -2.367 1.00 22.12 H new ATOM 0 HA ALA A 93 10.165 -27.285 0.408 1.00 74.51 H new ATOM 0 HB1 ALA A 93 12.338 -26.324 -0.274 1.00 61.14 H new ATOM 0 HB2 ALA A 93 12.016 -27.872 -1.090 1.00 61.14 H new ATOM 0 HB3 ALA A 93 11.805 -26.341 -1.972 1.00 61.14 H new ATOM 1376 N ALA A 94 9.843 -24.546 -1.424 1.00 13.34 N ATOM 1377 CA ALA A 94 9.452 -23.143 -1.363 1.00 1.30 C ATOM 1378 C ALA A 94 8.090 -22.980 -0.696 1.00 24.30 C ATOM 1379 O ALA A 94 7.918 -22.141 0.188 1.00 53.55 O ATOM 1380 CB ALA A 94 9.433 -22.539 -2.760 1.00 21.34 C ATOM 0 H ALA A 94 10.125 -24.866 -2.351 1.00 13.34 H new ATOM 0 HA ALA A 94 10.188 -22.613 -0.759 1.00 1.30 H new ATOM 0 HB1 ALA A 94 9.139 -21.491 -2.699 1.00 21.34 H new ATOM 0 HB2 ALA A 94 10.427 -22.612 -3.202 1.00 21.34 H new ATOM 0 HB3 ALA A 94 8.719 -23.080 -3.381 1.00 21.34 H new ATOM 1386 N ARG A 95 7.126 -23.788 -1.125 1.00 24.30 N ATOM 1387 CA ARG A 95 5.779 -23.732 -0.570 1.00 64.32 C ATOM 1388 C ARG A 95 5.776 -24.161 0.894 1.00 3.54 C ATOM 1389 O ARG A 95 5.020 -23.626 1.706 1.00 24.31 O ATOM 1390 CB ARG A 95 4.835 -24.627 -1.376 1.00 44.40 C ATOM 1391 CG ARG A 95 3.370 -24.245 -1.240 1.00 24.25 C ATOM 1392 CD ARG A 95 2.456 -25.381 -1.672 1.00 44.25 C ATOM 1393 NE ARG A 95 1.046 -25.017 -1.571 1.00 53.22 N ATOM 1394 CZ ARG A 95 0.386 -24.945 -0.420 1.00 41.44 C ATOM 1395 NH1 ARG A 95 1.007 -25.210 0.721 1.00 54.41 N ATOM 1396 NH2 ARG A 95 -0.897 -24.606 -0.410 1.00 21.32 N ATOM 0 H ARG A 95 7.253 -24.489 -1.855 1.00 24.30 H new ATOM 0 HA ARG A 95 5.431 -22.701 -0.630 1.00 64.32 H new ATOM 0 HB2 ARG A 95 5.117 -24.584 -2.428 1.00 44.40 H new ATOM 0 HB3 ARG A 95 4.964 -25.660 -1.054 1.00 44.40 H new ATOM 0 HG2 ARG A 95 3.157 -23.979 -0.205 1.00 24.25 H new ATOM 0 HG3 ARG A 95 3.165 -23.362 -1.845 1.00 24.25 H new ATOM 0 HD2 ARG A 95 2.686 -25.660 -2.700 1.00 44.25 H new ATOM 0 HD3 ARG A 95 2.649 -26.257 -1.053 1.00 44.25 H new ATOM 0 HE ARG A 95 0.540 -24.806 -2.431 1.00 53.22 H new ATOM 0 HH11 ARG A 95 1.993 -25.470 0.716 1.00 54.41 H new ATOM 0 HH12 ARG A 95 0.498 -25.154 1.603 1.00 54.41 H new ATOM 0 HH21 ARG A 95 -1.377 -24.401 -1.286 1.00 21.32 H new ATOM 0 HH22 ARG A 95 -1.403 -24.551 0.474 1.00 21.32 H new ATOM 1410 N ASP A 96 6.626 -25.127 1.224 1.00 34.34 N ATOM 1411 CA ASP A 96 6.722 -25.627 2.591 1.00 75.20 C ATOM 1412 C ASP A 96 7.273 -24.554 3.525 1.00 75.03 C ATOM 1413 O ASP A 96 6.790 -24.384 4.644 1.00 41.01 O ATOM 1414 CB ASP A 96 7.612 -26.870 2.641 1.00 74.03 C ATOM 1415 CG ASP A 96 7.753 -27.425 4.044 1.00 3.25 C ATOM 1416 OD1 ASP A 96 8.719 -27.044 4.739 1.00 41.42 O ATOM 1417 OD2 ASP A 96 6.898 -28.239 4.449 1.00 30.52 O ATOM 0 H ASP A 96 7.258 -25.580 0.564 1.00 34.34 H new ATOM 0 HA ASP A 96 5.719 -25.894 2.925 1.00 75.20 H new ATOM 0 HB2 ASP A 96 7.195 -27.638 1.990 1.00 74.03 H new ATOM 0 HB3 ASP A 96 8.599 -26.622 2.250 1.00 74.03 H new ATOM 1422 N ALA A 97 8.286 -23.833 3.057 1.00 65.53 N ATOM 1423 CA ALA A 97 8.902 -22.777 3.849 1.00 4.43 C ATOM 1424 C ALA A 97 7.904 -21.665 4.153 1.00 54.02 C ATOM 1425 O ALA A 97 7.923 -21.078 5.234 1.00 51.13 O ATOM 1426 CB ALA A 97 10.117 -22.214 3.126 1.00 61.21 C ATOM 0 H ALA A 97 8.697 -23.961 2.133 1.00 65.53 H new ATOM 0 HA ALA A 97 9.224 -23.210 4.796 1.00 4.43 H new ATOM 0 HB1 ALA A 97 10.567 -21.426 3.730 1.00 61.21 H new ATOM 0 HB2 ALA A 97 10.846 -23.009 2.966 1.00 61.21 H new ATOM 0 HB3 ALA A 97 9.810 -21.804 2.164 1.00 61.21 H new ATOM 1432 N GLY A 98 7.031 -21.380 3.191 1.00 62.35 N ATOM 1433 CA GLY A 98 6.037 -20.339 3.375 1.00 44.14 C ATOM 1434 C GLY A 98 6.222 -19.184 2.410 1.00 60.31 C ATOM 1435 O GLY A 98 5.944 -18.034 2.747 1.00 33.15 O ATOM 0 H GLY A 98 6.995 -21.852 2.287 1.00 62.35 H new ATOM 0 HA2 GLY A 98 5.042 -20.764 3.242 1.00 44.14 H new ATOM 0 HA3 GLY A 98 6.091 -19.966 4.398 1.00 44.14 H new ATOM 1439 N ALA A 99 6.694 -19.491 1.206 1.00 5.21 N ATOM 1440 CA ALA A 99 6.916 -18.470 0.190 1.00 52.24 C ATOM 1441 C ALA A 99 5.765 -18.432 -0.810 1.00 70.02 C ATOM 1442 O ALA A 99 5.195 -19.467 -1.157 1.00 21.31 O ATOM 1443 CB ALA A 99 8.234 -18.717 -0.529 1.00 31.41 C ATOM 0 H ALA A 99 6.930 -20.438 0.911 1.00 5.21 H new ATOM 0 HA ALA A 99 6.963 -17.502 0.688 1.00 52.24 H new ATOM 0 HB1 ALA A 99 8.386 -17.947 -1.285 1.00 31.41 H new ATOM 0 HB2 ALA A 99 9.052 -18.686 0.190 1.00 31.41 H new ATOM 0 HB3 ALA A 99 8.209 -19.696 -1.008 1.00 31.41 H new ATOM 1449 N THR A 100 5.426 -17.232 -1.271 1.00 3.22 N ATOM 1450 CA THR A 100 4.342 -17.059 -2.229 1.00 42.13 C ATOM 1451 C THR A 100 4.586 -17.881 -3.489 1.00 61.35 C ATOM 1452 O THR A 100 3.939 -18.904 -3.710 1.00 20.10 O ATOM 1453 CB THR A 100 4.169 -15.579 -2.621 1.00 62.31 C ATOM 1454 OG1 THR A 100 3.856 -14.799 -1.462 1.00 74.10 O ATOM 1455 CG2 THR A 100 3.069 -15.419 -3.659 1.00 73.51 C ATOM 0 H THR A 100 5.887 -16.365 -0.996 1.00 3.22 H new ATOM 0 HA THR A 100 3.431 -17.407 -1.742 1.00 42.13 H new ATOM 0 HB THR A 100 5.107 -15.228 -3.052 1.00 62.31 H new ATOM 0 HG1 THR A 100 3.072 -14.241 -1.646 1.00 74.10 H new ATOM 0 HG21 THR A 100 2.965 -14.366 -3.920 1.00 73.51 H new ATOM 0 HG22 THR A 100 3.325 -15.990 -4.551 1.00 73.51 H new ATOM 0 HG23 THR A 100 2.127 -15.786 -3.251 1.00 73.51 H new ATOM 1463 N GLY A 101 5.525 -17.428 -4.314 1.00 42.43 N ATOM 1464 CA GLY A 101 5.838 -18.134 -5.543 1.00 22.45 C ATOM 1465 C GLY A 101 7.330 -18.233 -5.790 1.00 64.53 C ATOM 1466 O GLY A 101 8.131 -17.724 -5.006 1.00 64.44 O ATOM 0 H GLY A 101 6.075 -16.584 -4.153 1.00 42.43 H new ATOM 0 HA2 GLY A 101 5.412 -19.137 -5.501 1.00 22.45 H new ATOM 0 HA3 GLY A 101 5.367 -17.623 -6.382 1.00 22.45 H new ATOM 1470 N TRP A 102 7.705 -18.891 -6.882 1.00 34.35 N ATOM 1471 CA TRP A 102 9.111 -19.057 -7.229 1.00 44.11 C ATOM 1472 C TRP A 102 9.332 -18.843 -8.722 1.00 50.05 C ATOM 1473 O TRP A 102 8.384 -18.859 -9.508 1.00 35.44 O ATOM 1474 CB TRP A 102 9.598 -20.449 -6.823 1.00 73.25 C ATOM 1475 CG TRP A 102 9.224 -21.518 -7.805 1.00 63.34 C ATOM 1476 CD1 TRP A 102 8.083 -21.582 -8.553 1.00 20.33 C ATOM 1477 CD2 TRP A 102 9.994 -22.677 -8.144 1.00 72.05 C ATOM 1478 NE1 TRP A 102 8.097 -22.711 -9.336 1.00 33.20 N ATOM 1479 CE2 TRP A 102 9.258 -23.399 -9.105 1.00 24.13 C ATOM 1480 CE3 TRP A 102 11.233 -23.174 -7.732 1.00 42.22 C ATOM 1481 CZ2 TRP A 102 9.723 -24.590 -9.656 1.00 34.41 C ATOM 1482 CZ3 TRP A 102 11.692 -24.356 -8.280 1.00 23.51 C ATOM 1483 CH2 TRP A 102 10.939 -25.054 -9.234 1.00 1.31 C ATOM 0 H TRP A 102 7.055 -19.318 -7.542 1.00 34.35 H new ATOM 0 HA TRP A 102 9.684 -18.307 -6.685 1.00 44.11 H new ATOM 0 HB2 TRP A 102 10.682 -20.429 -6.713 1.00 73.25 H new ATOM 0 HB3 TRP A 102 9.184 -20.701 -5.847 1.00 73.25 H new ATOM 0 HD1 TRP A 102 7.287 -20.853 -8.532 1.00 20.33 H new ATOM 0 HE1 TRP A 102 7.361 -22.991 -9.985 1.00 33.20 H new ATOM 0 HE3 TRP A 102 11.821 -22.643 -6.998 1.00 42.22 H new ATOM 0 HZ2 TRP A 102 9.144 -25.129 -10.391 1.00 34.41 H new ATOM 0 HZ3 TRP A 102 12.648 -24.749 -7.968 1.00 23.51 H new ATOM 0 HH2 TRP A 102 11.326 -25.975 -9.644 1.00 1.31 H new ATOM 1494 N ILE A 103 10.588 -18.643 -9.108 1.00 53.20 N ATOM 1495 CA ILE A 103 10.931 -18.427 -10.508 1.00 62.10 C ATOM 1496 C ILE A 103 12.329 -18.951 -10.818 1.00 62.41 C ATOM 1497 O ILE A 103 13.083 -19.308 -9.914 1.00 21.45 O ATOM 1498 CB ILE A 103 10.860 -16.935 -10.882 1.00 4.44 C ATOM 1499 CG1 ILE A 103 11.250 -16.067 -9.683 1.00 24.41 C ATOM 1500 CG2 ILE A 103 9.465 -16.576 -11.370 1.00 34.54 C ATOM 1501 CD1 ILE A 103 12.628 -16.374 -9.138 1.00 40.53 C ATOM 0 H ILE A 103 11.384 -18.626 -8.471 1.00 53.20 H new ATOM 0 HA ILE A 103 10.199 -18.976 -11.100 1.00 62.10 H new ATOM 0 HB ILE A 103 11.566 -16.745 -11.690 1.00 4.44 H new ATOM 0 HG12 ILE A 103 11.209 -15.018 -9.976 1.00 24.41 H new ATOM 0 HG13 ILE A 103 10.515 -16.206 -8.890 1.00 24.41 H new ATOM 0 HG21 ILE A 103 9.432 -15.518 -11.630 1.00 34.54 H new ATOM 0 HG22 ILE A 103 9.222 -17.174 -12.249 1.00 34.54 H new ATOM 0 HG23 ILE A 103 8.740 -16.779 -10.581 1.00 34.54 H new ATOM 0 HD11 ILE A 103 12.838 -15.722 -8.290 1.00 40.53 H new ATOM 0 HD12 ILE A 103 12.668 -17.414 -8.814 1.00 40.53 H new ATOM 0 HD13 ILE A 103 13.373 -16.208 -9.917 1.00 40.53 H new ATOM 1513 N GLU A 104 12.668 -18.993 -12.103 1.00 3.12 N ATOM 1514 CA GLU A 104 13.977 -19.473 -12.532 1.00 12.23 C ATOM 1515 C GLU A 104 14.873 -18.310 -12.949 1.00 33.10 C ATOM 1516 O GLU A 104 14.411 -17.339 -13.548 1.00 54.12 O ATOM 1517 CB GLU A 104 13.828 -20.458 -13.693 1.00 31.45 C ATOM 1518 CG GLU A 104 12.869 -19.986 -14.773 1.00 23.32 C ATOM 1519 CD GLU A 104 13.403 -20.225 -16.172 1.00 24.33 C ATOM 1520 OE1 GLU A 104 14.545 -19.802 -16.451 1.00 31.14 O ATOM 1521 OE2 GLU A 104 12.681 -20.835 -16.987 1.00 54.22 O ATOM 0 H GLU A 104 12.055 -18.701 -12.864 1.00 3.12 H new ATOM 0 HA GLU A 104 14.443 -19.984 -11.689 1.00 12.23 H new ATOM 0 HB2 GLU A 104 14.807 -20.631 -14.139 1.00 31.45 H new ATOM 0 HB3 GLU A 104 13.481 -21.415 -13.304 1.00 31.45 H new ATOM 0 HG2 GLU A 104 11.916 -20.503 -14.659 1.00 23.32 H new ATOM 0 HG3 GLU A 104 12.673 -18.922 -14.640 1.00 23.32 H new ATOM 1528 N LYS A 105 16.158 -18.416 -12.627 1.00 75.03 N ATOM 1529 CA LYS A 105 17.120 -17.376 -12.968 1.00 44.52 C ATOM 1530 C LYS A 105 17.933 -17.768 -14.198 1.00 24.14 C ATOM 1531 O LYS A 105 18.005 -18.937 -14.576 1.00 65.44 O ATOM 1532 CB LYS A 105 18.057 -17.112 -11.787 1.00 61.00 C ATOM 1533 CG LYS A 105 19.407 -17.797 -11.917 1.00 12.53 C ATOM 1534 CD LYS A 105 19.268 -19.310 -11.911 1.00 54.41 C ATOM 1535 CE LYS A 105 20.435 -19.979 -12.619 1.00 24.53 C ATOM 1536 NZ LYS A 105 21.632 -20.083 -11.738 1.00 41.44 N ATOM 0 H LYS A 105 16.557 -19.212 -12.130 1.00 75.03 H new ATOM 0 HA LYS A 105 16.567 -16.465 -13.196 1.00 44.52 H new ATOM 0 HB2 LYS A 105 18.212 -16.037 -11.690 1.00 61.00 H new ATOM 0 HB3 LYS A 105 17.575 -17.449 -10.869 1.00 61.00 H new ATOM 0 HG2 LYS A 105 19.890 -17.479 -12.841 1.00 12.53 H new ATOM 0 HG3 LYS A 105 20.054 -17.487 -11.096 1.00 12.53 H new ATOM 0 HD2 LYS A 105 19.212 -19.667 -10.883 1.00 54.41 H new ATOM 0 HD3 LYS A 105 18.335 -19.593 -12.398 1.00 54.41 H new ATOM 0 HE2 LYS A 105 20.138 -20.975 -12.947 1.00 24.53 H new ATOM 0 HE3 LYS A 105 20.691 -19.411 -13.514 1.00 24.53 H new ATOM 0 HZ1 LYS A 105 22.406 -20.545 -12.257 1.00 41.44 H new ATOM 0 HZ2 LYS A 105 21.931 -19.131 -11.445 1.00 41.44 H new ATOM 0 HZ3 LYS A 105 21.396 -20.646 -10.896 1.00 41.44 H new ATOM 1550 N PRO A 106 18.562 -16.770 -14.836 1.00 51.11 N ATOM 1551 CA PRO A 106 18.483 -15.374 -14.395 1.00 32.22 C ATOM 1552 C PRO A 106 17.098 -14.774 -14.615 1.00 23.24 C ATOM 1553 O PRO A 106 16.218 -15.416 -15.188 1.00 35.11 O ATOM 1554 CB PRO A 106 19.518 -14.666 -15.272 1.00 1.31 C ATOM 1555 CG PRO A 106 19.622 -15.511 -16.494 1.00 75.40 C ATOM 1556 CD PRO A 106 19.398 -16.927 -16.038 1.00 54.23 C ATOM 0 HA PRO A 106 18.670 -15.273 -13.326 1.00 32.22 H new ATOM 0 HB2 PRO A 106 19.201 -13.652 -15.518 1.00 1.31 H new ATOM 0 HB3 PRO A 106 20.479 -14.586 -14.764 1.00 1.31 H new ATOM 0 HG2 PRO A 106 18.879 -15.218 -17.236 1.00 75.40 H new ATOM 0 HG3 PRO A 106 20.600 -15.402 -16.962 1.00 75.40 H new ATOM 0 HD2 PRO A 106 18.896 -17.521 -16.802 1.00 54.23 H new ATOM 0 HD3 PRO A 106 20.338 -17.430 -15.811 1.00 54.23 H new ATOM 1564 N ILE A 107 16.913 -13.541 -14.156 1.00 44.11 N ATOM 1565 CA ILE A 107 15.636 -12.855 -14.305 1.00 1.33 C ATOM 1566 C ILE A 107 15.774 -11.622 -15.191 1.00 43.41 C ATOM 1567 O ILE A 107 16.764 -10.894 -15.109 1.00 53.54 O ATOM 1568 CB ILE A 107 15.063 -12.430 -12.940 1.00 31.33 C ATOM 1569 CG1 ILE A 107 15.021 -13.626 -11.986 1.00 14.22 C ATOM 1570 CG2 ILE A 107 13.674 -11.833 -13.111 1.00 3.11 C ATOM 1571 CD1 ILE A 107 14.043 -14.700 -12.407 1.00 34.43 C ATOM 0 H ILE A 107 17.631 -12.997 -13.678 1.00 44.11 H new ATOM 0 HA ILE A 107 14.951 -13.562 -14.774 1.00 1.33 H new ATOM 0 HB ILE A 107 15.714 -11.668 -12.510 1.00 31.33 H new ATOM 0 HG12 ILE A 107 16.018 -14.061 -11.917 1.00 14.22 H new ATOM 0 HG13 ILE A 107 14.756 -13.276 -10.988 1.00 14.22 H new ATOM 0 HG21 ILE A 107 13.283 -11.538 -12.138 1.00 3.11 H new ATOM 0 HG22 ILE A 107 13.731 -10.959 -13.760 1.00 3.11 H new ATOM 0 HG23 ILE A 107 13.012 -12.574 -13.558 1.00 3.11 H new ATOM 0 HD11 ILE A 107 14.066 -15.516 -11.685 1.00 34.43 H new ATOM 0 HD12 ILE A 107 13.038 -14.281 -12.448 1.00 34.43 H new ATOM 0 HD13 ILE A 107 14.319 -15.078 -13.391 1.00 34.43 H new ATOM 1583 N ASP A 108 14.775 -11.393 -16.036 1.00 44.52 N ATOM 1584 CA ASP A 108 14.783 -10.245 -16.937 1.00 24.35 C ATOM 1585 C ASP A 108 14.343 -8.980 -16.208 1.00 15.30 C ATOM 1586 O ASP A 108 13.625 -9.027 -15.209 1.00 34.21 O ATOM 1587 CB ASP A 108 13.869 -10.504 -18.135 1.00 14.13 C ATOM 1588 CG ASP A 108 14.637 -10.609 -19.437 1.00 72.45 C ATOM 1589 OD1 ASP A 108 15.610 -11.390 -19.491 1.00 60.53 O ATOM 1590 OD2 ASP A 108 14.264 -9.912 -20.404 1.00 3.55 O ATOM 0 H ASP A 108 13.949 -11.986 -16.116 1.00 44.52 H new ATOM 0 HA ASP A 108 15.803 -10.100 -17.294 1.00 24.35 H new ATOM 0 HB2 ASP A 108 13.311 -11.426 -17.970 1.00 14.13 H new ATOM 0 HB3 ASP A 108 13.138 -9.699 -18.212 1.00 14.13 H new ATOM 1595 N PRO A 109 14.782 -7.819 -16.718 1.00 22.54 N ATOM 1596 CA PRO A 109 14.446 -6.519 -16.131 1.00 12.03 C ATOM 1597 C PRO A 109 12.976 -6.159 -16.322 1.00 65.14 C ATOM 1598 O PRO A 109 12.370 -5.509 -15.472 1.00 5.11 O ATOM 1599 CB PRO A 109 15.340 -5.542 -16.898 1.00 1.33 C ATOM 1600 CG PRO A 109 15.606 -6.214 -18.201 1.00 15.35 C ATOM 1601 CD PRO A 109 15.641 -7.688 -17.906 1.00 42.14 C ATOM 0 HA PRO A 109 14.604 -6.506 -15.053 1.00 12.03 H new ATOM 0 HB2 PRO A 109 14.845 -4.582 -17.042 1.00 1.33 H new ATOM 0 HB3 PRO A 109 16.266 -5.345 -16.358 1.00 1.33 H new ATOM 0 HG2 PRO A 109 14.828 -5.980 -18.927 1.00 15.35 H new ATOM 0 HG3 PRO A 109 16.551 -5.879 -18.627 1.00 15.35 H new ATOM 0 HD2 PRO A 109 15.261 -8.274 -18.743 1.00 42.14 H new ATOM 0 HD3 PRO A 109 16.655 -8.034 -17.708 1.00 42.14 H new ATOM 1609 N GLY A 110 12.409 -6.587 -17.446 1.00 34.20 N ATOM 1610 CA GLY A 110 11.014 -6.300 -17.728 1.00 63.44 C ATOM 1611 C GLY A 110 10.069 -7.145 -16.898 1.00 32.33 C ATOM 1612 O GLY A 110 9.070 -6.645 -16.379 1.00 64.44 O ATOM 0 H GLY A 110 12.890 -7.127 -18.166 1.00 34.20 H new ATOM 0 HA2 GLY A 110 10.817 -5.245 -17.536 1.00 63.44 H new ATOM 0 HA3 GLY A 110 10.817 -6.473 -18.786 1.00 63.44 H new ATOM 1616 N VAL A 111 10.382 -8.431 -16.772 1.00 2.05 N ATOM 1617 CA VAL A 111 9.553 -9.348 -15.999 1.00 12.34 C ATOM 1618 C VAL A 111 9.560 -8.981 -14.519 1.00 4.12 C ATOM 1619 O VAL A 111 8.507 -8.867 -13.891 1.00 11.33 O ATOM 1620 CB VAL A 111 10.028 -10.804 -16.158 1.00 32.24 C ATOM 1621 CG1 VAL A 111 9.146 -11.745 -15.351 1.00 55.11 C ATOM 1622 CG2 VAL A 111 10.043 -11.202 -17.626 1.00 0.12 C ATOM 0 H VAL A 111 11.204 -8.861 -17.196 1.00 2.05 H new ATOM 0 HA VAL A 111 8.538 -9.261 -16.387 1.00 12.34 H new ATOM 0 HB VAL A 111 11.045 -10.880 -15.774 1.00 32.24 H new ATOM 0 HG11 VAL A 111 9.497 -12.769 -15.476 1.00 55.11 H new ATOM 0 HG12 VAL A 111 9.191 -11.472 -14.297 1.00 55.11 H new ATOM 0 HG13 VAL A 111 8.117 -11.669 -15.701 1.00 55.11 H new ATOM 0 HG21 VAL A 111 10.381 -12.234 -17.720 1.00 0.12 H new ATOM 0 HG22 VAL A 111 9.038 -11.111 -18.038 1.00 0.12 H new ATOM 0 HG23 VAL A 111 10.721 -10.547 -18.174 1.00 0.12 H new ATOM 1632 N LEU A 112 10.755 -8.797 -13.967 1.00 14.11 N ATOM 1633 CA LEU A 112 10.900 -8.442 -12.559 1.00 44.25 C ATOM 1634 C LEU A 112 10.034 -7.236 -12.209 1.00 71.34 C ATOM 1635 O LEU A 112 9.267 -7.268 -11.247 1.00 23.04 O ATOM 1636 CB LEU A 112 12.366 -8.142 -12.238 1.00 55.30 C ATOM 1637 CG LEU A 112 12.690 -7.878 -10.767 1.00 74.01 C ATOM 1638 CD1 LEU A 112 12.553 -9.155 -9.953 1.00 63.42 C ATOM 1639 CD2 LEU A 112 14.090 -7.300 -10.625 1.00 11.41 C ATOM 0 H LEU A 112 11.636 -8.888 -14.472 1.00 14.11 H new ATOM 0 HA LEU A 112 10.568 -9.290 -11.960 1.00 44.25 H new ATOM 0 HB2 LEU A 112 12.971 -8.983 -12.577 1.00 55.30 H new ATOM 0 HB3 LEU A 112 12.674 -7.273 -12.819 1.00 55.30 H new ATOM 0 HG LEU A 112 11.977 -7.149 -10.383 1.00 74.01 H new ATOM 0 HD11 LEU A 112 12.787 -8.948 -8.909 1.00 63.42 H new ATOM 0 HD12 LEU A 112 11.531 -9.527 -10.029 1.00 63.42 H new ATOM 0 HD13 LEU A 112 13.242 -9.907 -10.337 1.00 63.42 H new ATOM 0 HD21 LEU A 112 14.304 -7.118 -9.572 1.00 11.41 H new ATOM 0 HD22 LEU A 112 14.817 -8.006 -11.026 1.00 11.41 H new ATOM 0 HD23 LEU A 112 14.154 -6.361 -11.175 1.00 11.41 H new ATOM 1651 N VAL A 113 10.160 -6.174 -12.999 1.00 35.30 N ATOM 1652 CA VAL A 113 9.386 -4.959 -12.775 1.00 33.22 C ATOM 1653 C VAL A 113 7.889 -5.234 -12.875 1.00 65.20 C ATOM 1654 O VAL A 113 7.088 -4.625 -12.167 1.00 62.20 O ATOM 1655 CB VAL A 113 9.763 -3.859 -13.785 1.00 20.13 C ATOM 1656 CG1 VAL A 113 8.914 -2.617 -13.563 1.00 3.50 C ATOM 1657 CG2 VAL A 113 11.244 -3.528 -13.683 1.00 23.23 C ATOM 0 H VAL A 113 10.791 -6.131 -13.800 1.00 35.30 H new ATOM 0 HA VAL A 113 9.623 -4.614 -11.768 1.00 33.22 H new ATOM 0 HB VAL A 113 9.565 -4.230 -14.791 1.00 20.13 H new ATOM 0 HG11 VAL A 113 9.194 -1.851 -14.286 1.00 3.50 H new ATOM 0 HG12 VAL A 113 7.861 -2.868 -13.691 1.00 3.50 H new ATOM 0 HG13 VAL A 113 9.077 -2.241 -12.553 1.00 3.50 H new ATOM 0 HG21 VAL A 113 11.493 -2.749 -14.404 1.00 23.23 H new ATOM 0 HG22 VAL A 113 11.470 -3.177 -12.676 1.00 23.23 H new ATOM 0 HG23 VAL A 113 11.832 -4.421 -13.896 1.00 23.23 H new ATOM 1667 N GLU A 114 7.521 -6.156 -13.759 1.00 54.11 N ATOM 1668 CA GLU A 114 6.120 -6.511 -13.952 1.00 35.23 C ATOM 1669 C GLU A 114 5.577 -7.263 -12.739 1.00 41.53 C ATOM 1670 O GLU A 114 4.425 -7.078 -12.344 1.00 41.52 O ATOM 1671 CB GLU A 114 5.955 -7.366 -15.210 1.00 44.33 C ATOM 1672 CG GLU A 114 6.178 -6.596 -16.502 1.00 34.34 C ATOM 1673 CD GLU A 114 6.704 -7.474 -17.621 1.00 33.14 C ATOM 1674 OE1 GLU A 114 7.250 -6.923 -18.599 1.00 53.13 O ATOM 1675 OE2 GLU A 114 6.569 -8.711 -17.518 1.00 63.20 O ATOM 0 H GLU A 114 8.173 -6.670 -14.352 1.00 54.11 H new ATOM 0 HA GLU A 114 5.552 -5.588 -14.071 1.00 35.23 H new ATOM 0 HB2 GLU A 114 6.656 -8.199 -15.168 1.00 44.33 H new ATOM 0 HB3 GLU A 114 4.952 -7.794 -15.220 1.00 44.33 H new ATOM 0 HG2 GLU A 114 5.239 -6.139 -16.815 1.00 34.34 H new ATOM 0 HG3 GLU A 114 6.883 -5.785 -16.320 1.00 34.34 H new ATOM 1682 N LEU A 115 6.415 -8.111 -12.153 1.00 74.04 N ATOM 1683 CA LEU A 115 6.020 -8.892 -10.986 1.00 4.21 C ATOM 1684 C LEU A 115 5.742 -7.984 -9.792 1.00 41.23 C ATOM 1685 O LEU A 115 4.835 -8.242 -9.001 1.00 2.32 O ATOM 1686 CB LEU A 115 7.114 -9.901 -10.630 1.00 14.22 C ATOM 1687 CG LEU A 115 7.212 -11.130 -11.533 1.00 63.43 C ATOM 1688 CD1 LEU A 115 8.377 -12.012 -11.110 1.00 11.11 C ATOM 1689 CD2 LEU A 115 5.909 -11.916 -11.508 1.00 65.44 C ATOM 0 H LEU A 115 7.372 -8.275 -12.467 1.00 74.04 H new ATOM 0 HA LEU A 115 5.104 -9.429 -11.231 1.00 4.21 H new ATOM 0 HB2 LEU A 115 8.075 -9.386 -10.645 1.00 14.22 H new ATOM 0 HB3 LEU A 115 6.950 -10.239 -9.607 1.00 14.22 H new ATOM 0 HG LEU A 115 7.390 -10.793 -12.554 1.00 63.43 H new ATOM 0 HD11 LEU A 115 8.431 -12.882 -11.764 1.00 11.11 H new ATOM 0 HD12 LEU A 115 9.306 -11.446 -11.181 1.00 11.11 H new ATOM 0 HD13 LEU A 115 8.230 -12.340 -10.081 1.00 11.11 H new ATOM 0 HD21 LEU A 115 5.997 -12.788 -12.157 1.00 65.44 H new ATOM 0 HD22 LEU A 115 5.700 -12.242 -10.489 1.00 65.44 H new ATOM 0 HD23 LEU A 115 5.095 -11.282 -11.860 1.00 65.44 H new ATOM 1701 N VAL A 116 6.527 -6.918 -9.670 1.00 64.30 N ATOM 1702 CA VAL A 116 6.364 -5.970 -8.575 1.00 53.51 C ATOM 1703 C VAL A 116 5.295 -4.933 -8.901 1.00 55.13 C ATOM 1704 O VAL A 116 4.574 -4.470 -8.018 1.00 32.44 O ATOM 1705 CB VAL A 116 7.685 -5.245 -8.258 1.00 25.34 C ATOM 1706 CG1 VAL A 116 8.176 -4.472 -9.472 1.00 70.23 C ATOM 1707 CG2 VAL A 116 7.512 -4.321 -7.062 1.00 23.34 C ATOM 0 H VAL A 116 7.282 -6.690 -10.316 1.00 64.30 H new ATOM 0 HA VAL A 116 6.055 -6.545 -7.702 1.00 53.51 H new ATOM 0 HB VAL A 116 8.437 -5.993 -8.005 1.00 25.34 H new ATOM 0 HG11 VAL A 116 9.110 -3.967 -9.228 1.00 70.23 H new ATOM 0 HG12 VAL A 116 8.342 -5.162 -10.300 1.00 70.23 H new ATOM 0 HG13 VAL A 116 7.428 -3.733 -9.760 1.00 70.23 H new ATOM 0 HG21 VAL A 116 8.455 -3.817 -6.852 1.00 23.34 H new ATOM 0 HG22 VAL A 116 6.745 -3.579 -7.284 1.00 23.34 H new ATOM 0 HG23 VAL A 116 7.211 -4.905 -6.192 1.00 23.34 H new ATOM 1717 N ALA A 117 5.197 -4.573 -10.177 1.00 2.41 N ATOM 1718 CA ALA A 117 4.214 -3.592 -10.621 1.00 21.31 C ATOM 1719 C ALA A 117 2.816 -3.957 -10.134 1.00 20.44 C ATOM 1720 O ALA A 117 2.138 -3.151 -9.496 1.00 5.41 O ATOM 1721 CB ALA A 117 4.233 -3.476 -12.138 1.00 13.12 C ATOM 0 H ALA A 117 5.786 -4.946 -10.921 1.00 2.41 H new ATOM 0 HA ALA A 117 4.480 -2.627 -10.190 1.00 21.31 H new ATOM 0 HB1 ALA A 117 3.494 -2.740 -12.456 1.00 13.12 H new ATOM 0 HB2 ALA A 117 5.223 -3.161 -12.466 1.00 13.12 H new ATOM 0 HB3 ALA A 117 3.995 -4.444 -12.580 1.00 13.12 H new ATOM 1727 N THR A 118 2.388 -5.179 -10.438 1.00 42.22 N ATOM 1728 CA THR A 118 1.070 -5.650 -10.033 1.00 31.00 C ATOM 1729 C THR A 118 0.844 -5.435 -8.541 1.00 30.22 C ATOM 1730 O THR A 118 -0.273 -5.151 -8.106 1.00 40.22 O ATOM 1731 CB THR A 118 0.883 -7.144 -10.359 1.00 54.32 C ATOM 1732 OG1 THR A 118 -0.442 -7.560 -10.007 1.00 4.21 O ATOM 1733 CG2 THR A 118 1.901 -7.992 -9.614 1.00 24.44 C ATOM 0 H THR A 118 2.936 -5.860 -10.964 1.00 42.22 H new ATOM 0 HA THR A 118 0.340 -5.069 -10.596 1.00 31.00 H new ATOM 0 HB THR A 118 1.034 -7.281 -11.430 1.00 54.32 H new ATOM 0 HG1 THR A 118 -0.554 -8.510 -10.219 1.00 4.21 H new ATOM 0 HG21 THR A 118 1.749 -9.043 -9.860 1.00 24.44 H new ATOM 0 HG22 THR A 118 2.908 -7.693 -9.906 1.00 24.44 H new ATOM 0 HG23 THR A 118 1.777 -7.849 -8.540 1.00 24.44 H new ATOM 1741 N LEU A 119 1.910 -5.572 -7.760 1.00 40.02 N ATOM 1742 CA LEU A 119 1.828 -5.392 -6.315 1.00 1.22 C ATOM 1743 C LEU A 119 1.822 -3.911 -5.950 1.00 40.32 C ATOM 1744 O LEU A 119 1.148 -3.496 -5.007 1.00 63.11 O ATOM 1745 CB LEU A 119 3.000 -6.093 -5.626 1.00 62.44 C ATOM 1746 CG LEU A 119 3.387 -7.462 -6.188 1.00 51.01 C ATOM 1747 CD1 LEU A 119 4.691 -7.943 -5.571 1.00 33.32 C ATOM 1748 CD2 LEU A 119 2.275 -8.472 -5.945 1.00 52.21 C ATOM 0 H LEU A 119 2.841 -5.807 -8.103 1.00 40.02 H new ATOM 0 HA LEU A 119 0.894 -5.836 -5.971 1.00 1.22 H new ATOM 0 HB2 LEU A 119 3.871 -5.440 -5.681 1.00 62.44 H new ATOM 0 HB3 LEU A 119 2.757 -6.211 -4.570 1.00 62.44 H new ATOM 0 HG LEU A 119 3.533 -7.364 -7.264 1.00 51.01 H new ATOM 0 HD11 LEU A 119 4.950 -8.918 -5.983 1.00 33.32 H new ATOM 0 HD12 LEU A 119 5.485 -7.231 -5.797 1.00 33.32 H new ATOM 0 HD13 LEU A 119 4.574 -8.025 -4.490 1.00 33.32 H new ATOM 0 HD21 LEU A 119 2.568 -9.440 -6.351 1.00 52.21 H new ATOM 0 HD22 LEU A 119 2.097 -8.567 -4.874 1.00 52.21 H new ATOM 0 HD23 LEU A 119 1.362 -8.133 -6.436 1.00 52.21 H new ATOM 1760 N SER A 120 2.575 -3.118 -6.705 1.00 44.52 N ATOM 1761 CA SER A 120 2.658 -1.682 -6.461 1.00 21.33 C ATOM 1762 C SER A 120 1.288 -1.027 -6.606 1.00 2.35 C ATOM 1763 O SER A 120 0.950 -0.103 -5.867 1.00 11.32 O ATOM 1764 CB SER A 120 3.651 -1.035 -7.428 1.00 73.13 C ATOM 1765 OG SER A 120 3.328 0.326 -7.655 1.00 42.10 O ATOM 0 H SER A 120 3.137 -3.445 -7.491 1.00 44.52 H new ATOM 0 HA SER A 120 3.007 -1.531 -5.440 1.00 21.33 H new ATOM 0 HB2 SER A 120 4.660 -1.110 -7.022 1.00 73.13 H new ATOM 0 HB3 SER A 120 3.647 -1.576 -8.374 1.00 73.13 H new ATOM 0 HG SER A 120 4.014 0.734 -8.224 1.00 42.10 H new ATOM 1771 N GLU A 121 0.505 -1.513 -7.563 1.00 53.33 N ATOM 1772 CA GLU A 121 -0.828 -0.973 -7.806 1.00 32.50 C ATOM 1773 C GLU A 121 -1.900 -1.892 -7.226 1.00 53.43 C ATOM 1774 O GLU A 121 -1.693 -3.091 -7.043 1.00 30.34 O ATOM 1775 CB GLU A 121 -1.060 -0.784 -9.306 1.00 54.24 C ATOM 1776 CG GLU A 121 -0.680 -1.996 -10.139 1.00 72.43 C ATOM 1777 CD GLU A 121 -1.449 -2.073 -11.444 1.00 14.42 C ATOM 1778 OE1 GLU A 121 -2.098 -3.111 -11.689 1.00 73.24 O ATOM 1779 OE2 GLU A 121 -1.402 -1.095 -12.219 1.00 15.21 O ATOM 0 H GLU A 121 0.770 -2.279 -8.182 1.00 53.33 H new ATOM 0 HA GLU A 121 -0.896 -0.004 -7.311 1.00 32.50 H new ATOM 0 HB2 GLU A 121 -2.111 -0.552 -9.476 1.00 54.24 H new ATOM 0 HB3 GLU A 121 -0.485 0.076 -9.648 1.00 54.24 H new ATOM 0 HG2 GLU A 121 0.388 -1.964 -10.353 1.00 72.43 H new ATOM 0 HG3 GLU A 121 -0.863 -2.901 -9.560 1.00 72.43 H new ATOM 1786 N PRO A 122 -3.075 -1.316 -6.930 1.00 40.33 N ATOM 1787 CA PRO A 122 -4.203 -2.063 -6.367 1.00 74.01 C ATOM 1788 C PRO A 122 -4.819 -3.029 -7.374 1.00 11.14 C ATOM 1789 O PRO A 122 -4.523 -2.970 -8.566 1.00 44.44 O ATOM 1790 CB PRO A 122 -5.205 -0.967 -5.996 1.00 51.32 C ATOM 1791 CG PRO A 122 -4.879 0.168 -6.905 1.00 61.20 C ATOM 1792 CD PRO A 122 -3.392 0.109 -7.123 1.00 52.31 C ATOM 0 HA PRO A 122 -3.900 -2.685 -5.525 1.00 74.01 H new ATOM 0 HB2 PRO A 122 -6.232 -1.305 -6.137 1.00 51.32 H new ATOM 0 HB3 PRO A 122 -5.106 -0.677 -4.950 1.00 51.32 H new ATOM 0 HG2 PRO A 122 -5.416 0.078 -7.849 1.00 61.20 H new ATOM 0 HG3 PRO A 122 -5.171 1.120 -6.461 1.00 61.20 H new ATOM 0 HD2 PRO A 122 -3.118 0.450 -8.122 1.00 52.31 H new ATOM 0 HD3 PRO A 122 -2.856 0.739 -6.413 1.00 52.31 H new ATOM 1800 N ALA A 123 -5.678 -3.918 -6.885 1.00 0.42 N ATOM 1801 CA ALA A 123 -6.337 -4.894 -7.742 1.00 73.55 C ATOM 1802 C ALA A 123 -7.839 -4.639 -7.812 1.00 31.34 C ATOM 1803 O ALA A 123 -8.330 -3.626 -7.314 1.00 24.30 O ATOM 1804 CB ALA A 123 -6.062 -6.305 -7.244 1.00 31.41 C ATOM 0 H ALA A 123 -5.933 -3.982 -5.899 1.00 0.42 H new ATOM 0 HA ALA A 123 -5.930 -4.790 -8.748 1.00 73.55 H new ATOM 0 HB1 ALA A 123 -6.561 -7.024 -7.894 1.00 31.41 H new ATOM 0 HB2 ALA A 123 -4.988 -6.491 -7.253 1.00 31.41 H new ATOM 0 HB3 ALA A 123 -6.440 -6.412 -6.227 1.00 31.41 H new ATOM 1810 N ALA A 124 -8.564 -5.564 -8.432 1.00 61.43 N ATOM 1811 CA ALA A 124 -10.010 -5.440 -8.565 1.00 51.31 C ATOM 1812 C ALA A 124 -10.664 -6.805 -8.751 1.00 40.30 C ATOM 1813 O ALA A 124 -11.586 -6.958 -9.551 1.00 43.22 O ATOM 1814 CB ALA A 124 -10.356 -4.524 -9.730 1.00 11.55 C ATOM 0 H ALA A 124 -8.173 -6.408 -8.850 1.00 61.43 H new ATOM 0 HA ALA A 124 -10.398 -5.003 -7.645 1.00 51.31 H new ATOM 0 HB1 ALA A 124 -11.439 -4.440 -9.818 1.00 11.55 H new ATOM 0 HB2 ALA A 124 -9.929 -3.536 -9.556 1.00 11.55 H new ATOM 0 HB3 ALA A 124 -9.948 -4.938 -10.652 1.00 11.55 H new ATOM 1820 N ASN A 125 -10.180 -7.794 -8.007 1.00 1.10 N ATOM 1821 CA ASN A 125 -10.717 -9.147 -8.091 1.00 71.23 C ATOM 1822 C ASN A 125 -12.199 -9.168 -7.727 1.00 65.00 C ATOM 1823 O ASN A 125 -13.021 -9.712 -8.463 1.00 61.14 O ATOM 1824 CB ASN A 125 -9.940 -10.085 -7.166 1.00 64.40 C ATOM 1825 CG ASN A 125 -9.798 -9.527 -5.763 1.00 62.31 C ATOM 1826 OD1 ASN A 125 -8.747 -9.002 -5.396 1.00 11.45 O ATOM 1827 ND2 ASN A 125 -10.858 -9.640 -4.972 1.00 13.22 N ATOM 0 H ASN A 125 -9.417 -7.684 -7.339 1.00 1.10 H new ATOM 0 HA ASN A 125 -10.609 -9.491 -9.120 1.00 71.23 H new ATOM 0 HB2 ASN A 125 -10.447 -11.049 -7.121 1.00 64.40 H new ATOM 0 HB3 ASN A 125 -8.950 -10.265 -7.584 1.00 64.40 H new ATOM 0 HD21 ASN A 125 -10.822 -9.284 -4.017 1.00 13.22 H new ATOM 0 HD22 ASN A 125 -11.709 -10.083 -5.319 1.00 13.22 H new TER 1834 ASN A 125