USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 908 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 61 THR OG1 : rot 36:sc= -1.67! USER MOD Set 1.2: A 62 HIS : no HD1:sc= -6.14! C(o=-7.8!,f=-6.8!) USER MOD Set 2.1: A 42 MET CE :methyl 169:sc= -2.28 (180deg=-2.35!) USER MOD Set 2.2: A 54 ASN : amide:sc= -0.456 X(o=-2.7,f=-2.4) USER MOD Set 3.1: A 31 LYS NZ :NH3+ 159:sc= 0.014 (180deg=0) USER MOD Set 3.2: A 68 ASN : amide:sc= -1.02! X(o=-1!,f=-1.2) USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0628 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 1:sc= 0.642 USER MOD Single : A 12 MET CE :methyl -172:sc= 0 (180deg=-0.0419) USER MOD Single : A 14 SER OG : rot 41:sc= 0.65 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 32 LYS NZ :NH3+ -164:sc= -0.0134 (180deg=-0.215) USER MOD Single : A 33 MET CE :methyl -128:sc= -0.414 (180deg=-1.11) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0121 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0534 X(o=-0.053,f=-0.011) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.157 K(o=-0.16,f=-0.88) USER MOD Single : A 80 GLN : amide:sc= -11.5! C(o=-11!,f=-10!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc=-0.00306 USER MOD Single : A 87 GLN : amide:sc= -0.0111 X(o=-0.011,f=-0.037) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 99 CYS SG : rot 148:sc= -7.2! USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 MET CE :methyl -130:sc= -0.0498 (180deg=-0.359) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.396 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 HIS : no HE2:sc= -2.74! C(o=-2.7!,f=-5.1!) USER MOD Single : A 113 GLN : amide:sc= -1.61 K(o=-1.6,f=-3.9!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= -0.0664 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.231 51.782 -18.448 1.00 0.00 N ATOM 2 CA GLY A 1 -23.096 50.375 -18.783 1.00 0.00 C ATOM 3 C GLY A 1 -21.632 50.008 -19.030 1.00 0.00 C ATOM 4 O GLY A 1 -20.816 50.873 -19.347 1.00 0.00 O ATOM 0 H1 GLY A 1 -23.545 51.875 -17.461 1.00 0.00 H new ATOM 0 H2 GLY A 1 -22.313 52.257 -18.566 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.932 52.223 -19.077 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.496 49.765 -17.973 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.686 50.151 -19.672 1.00 0.00 H new ATOM 8 N SER A 2 -21.342 48.724 -18.876 1.00 0.00 N ATOM 9 CA SER A 2 -19.990 48.232 -19.078 1.00 0.00 C ATOM 10 C SER A 2 -20.023 46.918 -19.862 1.00 0.00 C ATOM 11 O SER A 2 -21.069 46.279 -19.965 1.00 0.00 O ATOM 12 CB SER A 2 -19.270 48.036 -17.743 1.00 0.00 C ATOM 13 OG SER A 2 -17.853 48.079 -17.889 1.00 0.00 O ATOM 0 H SER A 2 -22.021 48.009 -18.614 1.00 0.00 H new ATOM 0 HA SER A 2 -19.437 48.976 -19.652 1.00 0.00 H new ATOM 0 HB2 SER A 2 -19.586 48.810 -17.044 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.561 47.078 -17.311 1.00 0.00 H new ATOM 0 HG SER A 2 -17.430 47.952 -17.014 1.00 0.00 H new ATOM 19 N SER A 3 -18.866 46.554 -20.393 1.00 0.00 N ATOM 20 CA SER A 3 -18.749 45.328 -21.164 1.00 0.00 C ATOM 21 C SER A 3 -17.274 44.981 -21.375 1.00 0.00 C ATOM 22 O SER A 3 -16.398 45.814 -21.149 1.00 0.00 O ATOM 23 CB SER A 3 -19.463 45.454 -22.512 1.00 0.00 C ATOM 24 OG SER A 3 -19.724 44.183 -23.099 1.00 0.00 O ATOM 0 H SER A 3 -18.001 47.087 -20.305 1.00 0.00 H new ATOM 0 HA SER A 3 -19.228 44.525 -20.604 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.402 45.990 -22.376 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.852 46.048 -23.191 1.00 0.00 H new ATOM 0 HG SER A 3 -20.182 44.307 -23.957 1.00 0.00 H new ATOM 30 N GLY A 4 -17.045 43.749 -21.806 1.00 0.00 N ATOM 31 CA GLY A 4 -15.691 43.282 -22.050 1.00 0.00 C ATOM 32 C GLY A 4 -15.468 41.899 -21.433 1.00 0.00 C ATOM 33 O GLY A 4 -15.644 41.717 -20.229 1.00 0.00 O ATOM 0 H GLY A 4 -17.774 43.060 -21.992 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.505 43.240 -23.123 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.977 43.991 -21.631 1.00 0.00 H new ATOM 37 N SER A 5 -15.085 40.960 -22.286 1.00 0.00 N ATOM 38 CA SER A 5 -14.837 39.600 -21.839 1.00 0.00 C ATOM 39 C SER A 5 -14.297 38.759 -22.998 1.00 0.00 C ATOM 40 O SER A 5 -15.052 38.351 -23.878 1.00 0.00 O ATOM 41 CB SER A 5 -16.108 38.966 -21.271 1.00 0.00 C ATOM 42 OG SER A 5 -15.850 38.230 -20.078 1.00 0.00 O ATOM 0 H SER A 5 -14.940 41.114 -23.284 1.00 0.00 H new ATOM 0 HA SER A 5 -14.093 39.632 -21.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.841 39.746 -21.065 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.548 38.304 -22.017 1.00 0.00 H new ATOM 0 HG SER A 5 -16.686 37.842 -19.746 1.00 0.00 H new ATOM 48 N SER A 6 -12.993 38.526 -22.960 1.00 0.00 N ATOM 49 CA SER A 6 -12.343 37.741 -23.996 1.00 0.00 C ATOM 50 C SER A 6 -11.440 36.682 -23.361 1.00 0.00 C ATOM 51 O SER A 6 -10.671 36.982 -22.448 1.00 0.00 O ATOM 52 CB SER A 6 -11.533 38.634 -24.937 1.00 0.00 C ATOM 53 OG SER A 6 -11.608 38.192 -26.289 1.00 0.00 O ATOM 0 H SER A 6 -12.369 38.867 -22.228 1.00 0.00 H new ATOM 0 HA SER A 6 -13.115 37.245 -24.584 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.900 39.658 -24.870 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.491 38.647 -24.617 1.00 0.00 H new ATOM 0 HG SER A 6 -11.079 38.789 -26.858 1.00 0.00 H new ATOM 59 N GLY A 7 -11.562 35.464 -23.868 1.00 0.00 N ATOM 60 CA GLY A 7 -10.766 34.359 -23.362 1.00 0.00 C ATOM 61 C GLY A 7 -10.640 33.250 -24.409 1.00 0.00 C ATOM 62 O GLY A 7 -11.629 32.860 -25.027 1.00 0.00 O ATOM 0 H GLY A 7 -12.201 35.218 -24.624 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.774 34.717 -23.085 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.225 33.960 -22.457 1.00 0.00 H new ATOM 66 N THR A 8 -9.415 32.774 -24.574 1.00 0.00 N ATOM 67 CA THR A 8 -9.146 31.717 -25.535 1.00 0.00 C ATOM 68 C THR A 8 -8.357 30.585 -24.876 1.00 0.00 C ATOM 69 O THR A 8 -7.311 30.821 -24.273 1.00 0.00 O ATOM 70 CB THR A 8 -8.428 32.340 -26.734 1.00 0.00 C ATOM 71 OG1 THR A 8 -7.114 32.607 -26.252 1.00 0.00 O ATOM 72 CG2 THR A 8 -8.980 33.721 -27.095 1.00 0.00 C ATOM 0 H THR A 8 -8.597 33.100 -24.059 1.00 0.00 H new ATOM 0 HA THR A 8 -10.070 31.262 -25.891 1.00 0.00 H new ATOM 0 HB THR A 8 -8.518 31.677 -27.595 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.043 32.318 -25.318 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.436 34.118 -27.952 1.00 0.00 H new ATOM 0 HG22 THR A 8 -10.038 33.636 -27.345 1.00 0.00 H new ATOM 0 HG23 THR A 8 -8.860 34.394 -26.246 1.00 0.00 H new ATOM 80 N GLY A 9 -8.888 29.379 -25.013 1.00 0.00 N ATOM 81 CA GLY A 9 -8.246 28.209 -24.438 1.00 0.00 C ATOM 82 C GLY A 9 -8.330 27.014 -25.390 1.00 0.00 C ATOM 83 O GLY A 9 -7.481 26.853 -26.266 1.00 0.00 O ATOM 0 H GLY A 9 -9.756 29.187 -25.514 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -7.202 28.433 -24.221 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -8.722 27.958 -23.490 1.00 0.00 H new ATOM 87 N ALA A 10 -9.361 26.207 -25.187 1.00 0.00 N ATOM 88 CA ALA A 10 -9.566 25.032 -26.016 1.00 0.00 C ATOM 89 C ALA A 10 -10.869 24.344 -25.604 1.00 0.00 C ATOM 90 O ALA A 10 -10.849 23.238 -25.067 1.00 0.00 O ATOM 91 CB ALA A 10 -8.355 24.105 -25.898 1.00 0.00 C ATOM 0 H ALA A 10 -10.063 26.344 -24.460 1.00 0.00 H new ATOM 0 HA ALA A 10 -9.659 25.314 -27.065 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -8.510 23.224 -26.520 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -7.460 24.631 -26.230 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.231 23.799 -24.859 1.00 0.00 H new ATOM 97 N LEU A 11 -11.972 25.027 -25.872 1.00 0.00 N ATOM 98 CA LEU A 11 -13.282 24.495 -25.537 1.00 0.00 C ATOM 99 C LEU A 11 -13.252 23.940 -24.111 1.00 0.00 C ATOM 100 O LEU A 11 -13.488 22.751 -23.899 1.00 0.00 O ATOM 101 CB LEU A 11 -13.732 23.475 -26.585 1.00 0.00 C ATOM 102 CG LEU A 11 -14.776 23.964 -27.591 1.00 0.00 C ATOM 103 CD1 LEU A 11 -16.081 24.340 -26.888 1.00 0.00 C ATOM 104 CD2 LEU A 11 -14.227 25.115 -28.436 1.00 0.00 C ATOM 0 H LEU A 11 -11.986 25.944 -26.317 1.00 0.00 H new ATOM 0 HA LEU A 11 -14.031 25.287 -25.556 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.854 23.139 -27.137 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -14.135 22.605 -26.067 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.003 23.145 -28.273 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.806 24.684 -27.626 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.479 23.468 -26.368 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -15.890 25.136 -26.168 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.989 25.443 -29.143 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.953 25.946 -27.785 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.347 24.777 -28.983 1.00 0.00 H new ATOM 116 N MET A 12 -12.961 24.826 -23.171 1.00 0.00 N ATOM 117 CA MET A 12 -12.897 24.439 -21.772 1.00 0.00 C ATOM 118 C MET A 12 -12.614 25.650 -20.880 1.00 0.00 C ATOM 119 O MET A 12 -12.025 26.632 -21.330 1.00 0.00 O ATOM 120 CB MET A 12 -11.795 23.396 -21.580 1.00 0.00 C ATOM 121 CG MET A 12 -10.418 23.991 -21.881 1.00 0.00 C ATOM 122 SD MET A 12 -9.353 22.742 -22.585 1.00 0.00 S ATOM 123 CE MET A 12 -9.124 21.692 -21.160 1.00 0.00 C ATOM 0 H MET A 12 -12.767 25.811 -23.350 1.00 0.00 H new ATOM 0 HA MET A 12 -13.861 24.018 -21.487 1.00 0.00 H new ATOM 0 HB2 MET A 12 -11.818 23.022 -20.556 1.00 0.00 H new ATOM 0 HB3 MET A 12 -11.978 22.544 -22.235 1.00 0.00 H new ATOM 0 HG2 MET A 12 -10.518 24.828 -22.573 1.00 0.00 H new ATOM 0 HG3 MET A 12 -9.975 24.385 -20.966 1.00 0.00 H new ATOM 0 HE1 MET A 12 -8.369 20.937 -21.382 1.00 0.00 H new ATOM 0 HE2 MET A 12 -8.797 22.295 -20.313 1.00 0.00 H new ATOM 0 HE3 MET A 12 -10.066 21.202 -20.914 1.00 0.00 H new ATOM 133 N ALA A 13 -13.047 25.541 -19.633 1.00 0.00 N ATOM 134 CA ALA A 13 -12.847 26.614 -18.674 1.00 0.00 C ATOM 135 C ALA A 13 -11.866 26.153 -17.595 1.00 0.00 C ATOM 136 O ALA A 13 -10.814 26.762 -17.407 1.00 0.00 O ATOM 137 CB ALA A 13 -14.198 27.036 -18.092 1.00 0.00 C ATOM 0 H ALA A 13 -13.536 24.725 -19.264 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.414 27.488 -19.161 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.049 27.841 -17.372 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.848 27.383 -18.895 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.661 26.185 -17.593 1.00 0.00 H new ATOM 143 N SER A 14 -12.245 25.081 -16.915 1.00 0.00 N ATOM 144 CA SER A 14 -11.412 24.531 -15.859 1.00 0.00 C ATOM 145 C SER A 14 -11.839 23.095 -15.550 1.00 0.00 C ATOM 146 O SER A 14 -12.765 22.873 -14.771 1.00 0.00 O ATOM 147 CB SER A 14 -11.485 25.391 -14.595 1.00 0.00 C ATOM 148 OG SER A 14 -12.820 25.524 -14.117 1.00 0.00 O ATOM 0 H SER A 14 -13.118 24.578 -17.075 1.00 0.00 H new ATOM 0 HA SER A 14 -10.378 24.529 -16.205 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.864 24.946 -13.817 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.075 26.379 -14.804 1.00 0.00 H new ATOM 0 HG SER A 14 -13.281 24.662 -14.189 1.00 0.00 H new ATOM 154 N SER A 15 -11.143 22.157 -16.175 1.00 0.00 N ATOM 155 CA SER A 15 -11.439 20.748 -15.976 1.00 0.00 C ATOM 156 C SER A 15 -10.327 19.890 -16.582 1.00 0.00 C ATOM 157 O SER A 15 -10.463 19.385 -17.695 1.00 0.00 O ATOM 158 CB SER A 15 -12.790 20.377 -16.591 1.00 0.00 C ATOM 159 OG SER A 15 -13.319 19.178 -16.031 1.00 0.00 O ATOM 0 H SER A 15 -10.375 22.345 -16.819 1.00 0.00 H new ATOM 0 HA SER A 15 -11.494 20.558 -14.904 1.00 0.00 H new ATOM 0 HB2 SER A 15 -13.496 21.193 -16.435 1.00 0.00 H new ATOM 0 HB3 SER A 15 -12.677 20.255 -17.668 1.00 0.00 H new ATOM 0 HG SER A 15 -14.182 18.975 -16.448 1.00 0.00 H new ATOM 165 N PRO A 16 -9.222 19.746 -15.801 1.00 0.00 N ATOM 166 CA PRO A 16 -8.087 18.957 -16.249 1.00 0.00 C ATOM 167 C PRO A 16 -8.389 17.460 -16.157 1.00 0.00 C ATOM 168 O PRO A 16 -8.235 16.856 -15.096 1.00 0.00 O ATOM 169 CB PRO A 16 -6.933 19.386 -15.357 1.00 0.00 C ATOM 170 CG PRO A 16 -7.568 20.052 -14.147 1.00 0.00 C ATOM 171 CD PRO A 16 -9.025 20.329 -14.477 1.00 0.00 C ATOM 0 HA PRO A 16 -7.846 19.125 -17.299 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -6.330 18.528 -15.059 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -6.270 20.076 -15.880 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.491 19.406 -13.272 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.049 20.979 -13.906 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -9.691 19.876 -13.742 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -9.234 21.399 -14.480 1.00 0.00 H new ATOM 179 N GLN A 17 -8.814 16.904 -17.282 1.00 0.00 N ATOM 180 CA GLN A 17 -9.139 15.489 -17.341 1.00 0.00 C ATOM 181 C GLN A 17 -7.949 14.693 -17.879 1.00 0.00 C ATOM 182 O GLN A 17 -8.090 13.926 -18.830 1.00 0.00 O ATOM 183 CB GLN A 17 -10.389 15.249 -18.191 1.00 0.00 C ATOM 184 CG GLN A 17 -11.647 15.726 -17.463 1.00 0.00 C ATOM 185 CD GLN A 17 -12.866 15.681 -18.387 1.00 0.00 C ATOM 186 OE1 GLN A 17 -13.745 14.845 -18.256 1.00 0.00 O ATOM 187 NE2 GLN A 17 -12.869 16.623 -19.325 1.00 0.00 N ATOM 0 H GLN A 17 -8.941 17.408 -18.160 1.00 0.00 H new ATOM 0 HA GLN A 17 -9.355 15.143 -16.330 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -10.293 15.774 -19.141 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -10.478 14.187 -18.421 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -11.825 15.099 -16.589 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -11.498 16.743 -17.101 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -12.101 17.292 -19.378 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -13.639 16.677 -19.991 1.00 0.00 H new ATOM 196 N ASP A 18 -6.803 14.903 -17.248 1.00 0.00 N ATOM 197 CA ASP A 18 -5.589 14.215 -17.652 1.00 0.00 C ATOM 198 C ASP A 18 -4.819 13.774 -16.405 1.00 0.00 C ATOM 199 O ASP A 18 -4.052 14.551 -15.838 1.00 0.00 O ATOM 200 CB ASP A 18 -4.679 15.135 -18.468 1.00 0.00 C ATOM 201 CG ASP A 18 -4.503 14.735 -19.934 1.00 0.00 C ATOM 202 OD1 ASP A 18 -5.353 13.956 -20.416 1.00 0.00 O ATOM 203 OD2 ASP A 18 -3.521 15.217 -20.540 1.00 0.00 O ATOM 0 H ASP A 18 -6.690 15.540 -16.460 1.00 0.00 H new ATOM 0 HA ASP A 18 -5.875 13.358 -18.262 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -5.082 16.147 -18.429 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -3.698 15.164 -17.994 1.00 0.00 H new ATOM 208 N ILE A 19 -5.050 12.529 -16.015 1.00 0.00 N ATOM 209 CA ILE A 19 -4.388 11.976 -14.846 1.00 0.00 C ATOM 210 C ILE A 19 -2.884 12.235 -14.947 1.00 0.00 C ATOM 211 O ILE A 19 -2.288 12.052 -16.007 1.00 0.00 O ATOM 212 CB ILE A 19 -4.747 10.498 -14.677 1.00 0.00 C ATOM 213 CG1 ILE A 19 -6.137 10.339 -14.057 1.00 0.00 C ATOM 214 CG2 ILE A 19 -3.673 9.762 -13.873 1.00 0.00 C ATOM 215 CD1 ILE A 19 -6.592 8.879 -14.098 1.00 0.00 C ATOM 0 H ILE A 19 -5.687 11.888 -16.488 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.737 12.471 -13.940 1.00 0.00 H new ATOM 0 HB ILE A 19 -4.781 10.039 -15.665 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.121 10.690 -13.025 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.852 10.962 -14.594 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.952 8.714 -13.767 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -2.717 9.832 -14.393 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.583 10.215 -12.886 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.583 8.794 -13.651 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.630 8.539 -15.133 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.888 8.263 -13.539 1.00 0.00 H new ATOM 227 N LYS A 20 -2.313 12.658 -13.829 1.00 0.00 N ATOM 228 CA LYS A 20 -0.889 12.945 -13.777 1.00 0.00 C ATOM 229 C LYS A 20 -0.110 11.730 -14.285 1.00 0.00 C ATOM 230 O LYS A 20 0.682 11.842 -15.219 1.00 0.00 O ATOM 231 CB LYS A 20 -0.483 13.393 -12.372 1.00 0.00 C ATOM 232 CG LYS A 20 -0.112 14.877 -12.355 1.00 0.00 C ATOM 233 CD LYS A 20 0.636 15.241 -11.071 1.00 0.00 C ATOM 234 CE LYS A 20 1.649 16.359 -11.325 1.00 0.00 C ATOM 235 NZ LYS A 20 1.352 17.532 -10.473 1.00 0.00 N ATOM 0 H LYS A 20 -2.811 12.809 -12.952 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.644 13.779 -14.435 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -1.303 13.212 -11.677 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.364 12.799 -12.028 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.509 15.110 -13.220 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.015 15.482 -12.438 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.076 15.557 -10.308 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.150 14.361 -10.683 1.00 0.00 H new ATOM 0 HE2 LYS A 20 2.657 15.998 -11.119 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.623 16.649 -12.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 2.049 18.281 -10.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 0.398 17.886 -10.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.400 17.255 -9.472 1.00 0.00 H new ATOM 249 N PHE A 21 -0.362 10.597 -13.646 1.00 0.00 N ATOM 250 CA PHE A 21 0.307 9.362 -14.021 1.00 0.00 C ATOM 251 C PHE A 21 -0.688 8.356 -14.604 1.00 0.00 C ATOM 252 O PHE A 21 -1.658 7.984 -13.946 1.00 0.00 O ATOM 253 CB PHE A 21 0.916 8.778 -12.745 1.00 0.00 C ATOM 254 CG PHE A 21 1.511 9.827 -11.802 1.00 0.00 C ATOM 255 CD1 PHE A 21 2.787 10.259 -11.985 1.00 0.00 C ATOM 256 CD2 PHE A 21 0.763 10.327 -10.783 1.00 0.00 C ATOM 257 CE1 PHE A 21 3.339 11.232 -11.111 1.00 0.00 C ATOM 258 CE2 PHE A 21 1.315 11.300 -9.908 1.00 0.00 C ATOM 259 CZ PHE A 21 2.592 11.732 -10.091 1.00 0.00 C ATOM 0 H PHE A 21 -1.020 10.508 -12.871 1.00 0.00 H new ATOM 0 HA PHE A 21 1.065 9.564 -14.778 1.00 0.00 H new ATOM 0 HB2 PHE A 21 0.148 8.219 -12.211 1.00 0.00 H new ATOM 0 HB3 PHE A 21 1.695 8.067 -13.019 1.00 0.00 H new ATOM 0 HD1 PHE A 21 3.381 9.862 -12.795 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -0.251 9.984 -10.639 1.00 0.00 H new ATOM 0 HE1 PHE A 21 4.353 11.575 -11.256 1.00 0.00 H new ATOM 0 HE2 PHE A 21 0.721 11.697 -9.098 1.00 0.00 H new ATOM 0 HZ PHE A 21 3.012 12.472 -9.426 1.00 0.00 H new ATOM 269 N GLN A 22 -0.412 7.944 -15.833 1.00 0.00 N ATOM 270 CA GLN A 22 -1.270 6.989 -16.512 1.00 0.00 C ATOM 271 C GLN A 22 -0.769 5.563 -16.274 1.00 0.00 C ATOM 272 O GLN A 22 -1.026 4.668 -17.078 1.00 0.00 O ATOM 273 CB GLN A 22 -1.356 7.296 -18.008 1.00 0.00 C ATOM 274 CG GLN A 22 -2.211 8.539 -18.264 1.00 0.00 C ATOM 275 CD GLN A 22 -1.910 9.139 -19.639 1.00 0.00 C ATOM 276 OE1 GLN A 22 -1.464 8.465 -20.554 1.00 0.00 O ATOM 277 NE2 GLN A 22 -2.177 10.438 -19.733 1.00 0.00 N ATOM 0 H GLN A 22 0.394 8.254 -16.376 1.00 0.00 H new ATOM 0 HA GLN A 22 -2.275 7.075 -16.098 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.354 7.450 -18.409 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.782 6.442 -18.534 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -3.267 8.277 -18.201 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -2.020 9.282 -17.490 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -2.549 10.942 -18.928 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -2.010 10.931 -20.610 1.00 0.00 H new ATOM 286 N ASP A 23 -0.063 5.395 -15.165 1.00 0.00 N ATOM 287 CA ASP A 23 0.476 4.093 -14.811 1.00 0.00 C ATOM 288 C ASP A 23 0.867 4.093 -13.331 1.00 0.00 C ATOM 289 O ASP A 23 1.878 3.504 -12.953 1.00 0.00 O ATOM 290 CB ASP A 23 1.728 3.774 -15.630 1.00 0.00 C ATOM 291 CG ASP A 23 1.461 3.183 -17.016 1.00 0.00 C ATOM 292 OD1 ASP A 23 0.520 2.365 -17.112 1.00 0.00 O ATOM 293 OD2 ASP A 23 2.202 3.562 -17.948 1.00 0.00 O ATOM 0 H ASP A 23 0.148 6.139 -14.500 1.00 0.00 H new ATOM 0 HA ASP A 23 -0.289 3.344 -15.015 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.310 4.688 -15.747 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.344 3.074 -15.066 1.00 0.00 H new ATOM 298 N LEU A 24 0.045 4.762 -12.535 1.00 0.00 N ATOM 299 CA LEU A 24 0.292 4.846 -11.106 1.00 0.00 C ATOM 300 C LEU A 24 -1.012 4.583 -10.351 1.00 0.00 C ATOM 301 O LEU A 24 -1.471 5.428 -9.583 1.00 0.00 O ATOM 302 CB LEU A 24 0.948 6.183 -10.753 1.00 0.00 C ATOM 303 CG LEU A 24 2.073 6.126 -9.719 1.00 0.00 C ATOM 304 CD1 LEU A 24 1.530 5.753 -8.338 1.00 0.00 C ATOM 305 CD2 LEU A 24 3.187 5.179 -10.171 1.00 0.00 C ATOM 0 H LEU A 24 -0.792 5.250 -12.853 1.00 0.00 H new ATOM 0 HA LEU A 24 1.001 4.078 -10.796 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.344 6.623 -11.668 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.176 6.858 -10.383 1.00 0.00 H new ATOM 0 HG LEU A 24 2.510 7.121 -9.636 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.351 5.719 -7.621 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.801 6.498 -8.020 1.00 0.00 H new ATOM 0 HD13 LEU A 24 1.051 4.775 -8.387 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.974 5.157 -9.417 1.00 0.00 H new ATOM 0 HD22 LEU A 24 2.781 4.176 -10.301 1.00 0.00 H new ATOM 0 HD23 LEU A 24 3.600 5.529 -11.117 1.00 0.00 H new ATOM 317 N VAL A 25 -1.573 3.408 -10.595 1.00 0.00 N ATOM 318 CA VAL A 25 -2.816 3.023 -9.948 1.00 0.00 C ATOM 319 C VAL A 25 -2.532 2.644 -8.493 1.00 0.00 C ATOM 320 O VAL A 25 -1.818 1.677 -8.227 1.00 0.00 O ATOM 321 CB VAL A 25 -3.491 1.900 -10.737 1.00 0.00 C ATOM 322 CG1 VAL A 25 -4.942 1.711 -10.290 1.00 0.00 C ATOM 323 CG2 VAL A 25 -3.411 2.163 -12.242 1.00 0.00 C ATOM 0 H VAL A 25 -1.190 2.710 -11.232 1.00 0.00 H new ATOM 0 HA VAL A 25 -3.515 3.859 -9.936 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.953 0.975 -10.529 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.399 0.907 -10.867 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.966 1.457 -9.230 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.497 2.635 -10.454 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.898 1.350 -12.780 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.912 3.103 -12.474 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -2.366 2.224 -12.546 1.00 0.00 H new ATOM 333 N VAL A 26 -3.105 3.424 -7.588 1.00 0.00 N ATOM 334 CA VAL A 26 -2.923 3.182 -6.167 1.00 0.00 C ATOM 335 C VAL A 26 -4.242 2.697 -5.563 1.00 0.00 C ATOM 336 O VAL A 26 -5.263 3.375 -5.669 1.00 0.00 O ATOM 337 CB VAL A 26 -2.381 4.441 -5.488 1.00 0.00 C ATOM 338 CG1 VAL A 26 -2.338 4.268 -3.968 1.00 0.00 C ATOM 339 CG2 VAL A 26 -1.001 4.809 -6.037 1.00 0.00 C ATOM 0 H VAL A 26 -3.696 4.225 -7.812 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.184 2.397 -6.004 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.061 5.263 -5.713 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -1.949 5.177 -3.509 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -3.344 4.075 -3.595 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -1.690 3.428 -3.716 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.639 5.707 -5.538 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.307 3.988 -5.856 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.073 4.994 -7.109 1.00 0.00 H new ATOM 349 N PHE A 27 -4.178 1.528 -4.944 1.00 0.00 N ATOM 350 CA PHE A 27 -5.356 0.945 -4.323 1.00 0.00 C ATOM 351 C PHE A 27 -5.163 0.797 -2.812 1.00 0.00 C ATOM 352 O PHE A 27 -4.308 0.036 -2.363 1.00 0.00 O ATOM 353 CB PHE A 27 -5.545 -0.443 -4.939 1.00 0.00 C ATOM 354 CG PHE A 27 -6.539 -1.328 -4.184 1.00 0.00 C ATOM 355 CD1 PHE A 27 -6.128 -2.044 -3.103 1.00 0.00 C ATOM 356 CD2 PHE A 27 -7.834 -1.399 -4.594 1.00 0.00 C ATOM 357 CE1 PHE A 27 -7.051 -2.866 -2.403 1.00 0.00 C ATOM 358 CE2 PHE A 27 -8.757 -2.220 -3.894 1.00 0.00 C ATOM 359 CZ PHE A 27 -8.346 -2.936 -2.813 1.00 0.00 C ATOM 0 H PHE A 27 -3.329 0.968 -4.859 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.221 1.586 -4.491 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.884 -0.329 -5.969 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.580 -0.948 -4.976 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -5.100 -1.988 -2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -8.160 -0.831 -5.452 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.725 -3.435 -1.545 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -9.785 -2.276 -4.220 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.048 -3.560 -2.280 1.00 0.00 H new ATOM 369 N ILE A 28 -5.972 1.539 -2.070 1.00 0.00 N ATOM 370 CA ILE A 28 -5.901 1.501 -0.619 1.00 0.00 C ATOM 371 C ILE A 28 -6.669 0.280 -0.107 1.00 0.00 C ATOM 372 O ILE A 28 -7.664 -0.127 -0.706 1.00 0.00 O ATOM 373 CB ILE A 28 -6.383 2.825 -0.024 1.00 0.00 C ATOM 374 CG1 ILE A 28 -5.392 3.952 -0.319 1.00 0.00 C ATOM 375 CG2 ILE A 28 -6.662 2.684 1.474 1.00 0.00 C ATOM 376 CD1 ILE A 28 -5.802 5.243 0.391 1.00 0.00 C ATOM 0 H ILE A 28 -6.680 2.170 -2.446 1.00 0.00 H new ATOM 0 HA ILE A 28 -4.868 1.389 -0.291 1.00 0.00 H new ATOM 0 HB ILE A 28 -7.325 3.092 -0.503 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.394 3.657 0.004 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -5.342 4.124 -1.394 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -7.003 3.640 1.872 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -7.433 1.929 1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -5.749 2.382 1.987 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -5.080 6.028 0.164 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -6.790 5.549 0.048 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.828 5.074 1.467 1.00 0.00 H new ATOM 388 N LEU A 29 -6.179 -0.268 0.994 1.00 0.00 N ATOM 389 CA LEU A 29 -6.807 -1.434 1.593 1.00 0.00 C ATOM 390 C LEU A 29 -7.497 -1.023 2.896 1.00 0.00 C ATOM 391 O LEU A 29 -6.835 -0.648 3.862 1.00 0.00 O ATOM 392 CB LEU A 29 -5.787 -2.562 1.767 1.00 0.00 C ATOM 393 CG LEU A 29 -6.332 -3.878 2.326 1.00 0.00 C ATOM 394 CD1 LEU A 29 -7.308 -4.528 1.344 1.00 0.00 C ATOM 395 CD2 LEU A 29 -5.193 -4.823 2.713 1.00 0.00 C ATOM 0 H LEU A 29 -5.354 0.073 1.488 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.579 -1.832 0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.329 -2.763 0.799 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -4.995 -2.210 2.428 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.890 -3.658 3.236 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.681 -5.462 1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.144 -3.853 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.796 -4.733 0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.608 -5.751 3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.587 -5.041 1.834 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -4.571 -4.351 3.474 1.00 0.00 H new ATOM 407 N GLU A 30 -8.819 -1.107 2.879 1.00 0.00 N ATOM 408 CA GLU A 30 -9.607 -0.749 4.046 1.00 0.00 C ATOM 409 C GLU A 30 -9.065 -1.457 5.290 1.00 0.00 C ATOM 410 O GLU A 30 -8.701 -0.807 6.269 1.00 0.00 O ATOM 411 CB GLU A 30 -11.086 -1.075 3.831 1.00 0.00 C ATOM 412 CG GLU A 30 -11.941 -0.521 4.973 1.00 0.00 C ATOM 413 CD GLU A 30 -11.834 -1.405 6.217 1.00 0.00 C ATOM 414 OE1 GLU A 30 -12.197 -2.596 6.100 1.00 0.00 O ATOM 415 OE2 GLU A 30 -11.391 -0.871 7.256 1.00 0.00 O ATOM 0 H GLU A 30 -9.365 -1.418 2.075 1.00 0.00 H new ATOM 0 HA GLU A 30 -9.525 0.327 4.199 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -11.421 -0.653 2.883 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -11.218 -2.155 3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -11.620 0.492 5.214 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -12.982 -0.458 4.655 1.00 0.00 H new ATOM 422 N LYS A 31 -9.028 -2.779 5.210 1.00 0.00 N ATOM 423 CA LYS A 31 -8.537 -3.582 6.317 1.00 0.00 C ATOM 424 C LYS A 31 -8.491 -2.724 7.583 1.00 0.00 C ATOM 425 O LYS A 31 -9.521 -2.227 8.038 1.00 0.00 O ATOM 426 CB LYS A 31 -7.194 -4.222 5.960 1.00 0.00 C ATOM 427 CG LYS A 31 -7.381 -5.370 4.966 1.00 0.00 C ATOM 428 CD LYS A 31 -8.050 -6.572 5.637 1.00 0.00 C ATOM 429 CE LYS A 31 -7.097 -7.768 5.695 1.00 0.00 C ATOM 430 NZ LYS A 31 -6.607 -7.974 7.076 1.00 0.00 N ATOM 0 H LYS A 31 -9.330 -3.314 4.396 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.216 -4.411 6.517 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -6.531 -3.470 5.532 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -6.712 -4.594 6.864 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -7.988 -5.033 4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.413 -5.667 4.561 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -8.363 -6.302 6.646 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.950 -6.846 5.087 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.609 -8.665 5.347 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.254 -7.601 5.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.268 -8.952 7.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.826 -7.314 7.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.381 -7.801 7.748 1.00 0.00 H new ATOM 444 N LYS A 32 -7.288 -2.577 8.117 1.00 0.00 N ATOM 445 CA LYS A 32 -7.095 -1.788 9.322 1.00 0.00 C ATOM 446 C LYS A 32 -7.076 -0.302 8.956 1.00 0.00 C ATOM 447 O LYS A 32 -6.043 0.356 9.068 1.00 0.00 O ATOM 448 CB LYS A 32 -5.844 -2.252 10.072 1.00 0.00 C ATOM 449 CG LYS A 32 -6.071 -3.618 10.723 1.00 0.00 C ATOM 450 CD LYS A 32 -5.381 -4.726 9.925 1.00 0.00 C ATOM 451 CE LYS A 32 -5.408 -6.051 10.691 1.00 0.00 C ATOM 452 NZ LYS A 32 -4.489 -5.998 11.850 1.00 0.00 N ATOM 0 H LYS A 32 -6.437 -2.991 7.737 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.926 -1.937 10.012 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.002 -2.309 9.382 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.581 -1.520 10.836 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.688 -3.607 11.743 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.140 -3.822 10.786 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -5.877 -4.848 8.962 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -4.349 -4.442 9.719 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -6.422 -6.260 11.032 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -5.120 -6.867 10.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.309 -6.963 12.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -3.591 -5.560 11.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.921 -5.434 12.610 1.00 0.00 H new ATOM 466 N MET A 33 -8.232 0.183 8.526 1.00 0.00 N ATOM 467 CA MET A 33 -8.362 1.579 8.143 1.00 0.00 C ATOM 468 C MET A 33 -9.817 2.041 8.241 1.00 0.00 C ATOM 469 O MET A 33 -10.158 2.850 9.102 1.00 0.00 O ATOM 470 CB MET A 33 -7.862 1.763 6.708 1.00 0.00 C ATOM 471 CG MET A 33 -7.369 3.193 6.479 1.00 0.00 C ATOM 472 SD MET A 33 -5.594 3.204 6.293 1.00 0.00 S ATOM 473 CE MET A 33 -5.453 2.564 4.632 1.00 0.00 C ATOM 0 H MET A 33 -9.087 -0.366 8.434 1.00 0.00 H new ATOM 0 HA MET A 33 -7.763 2.182 8.826 1.00 0.00 H new ATOM 0 HB2 MET A 33 -7.054 1.059 6.507 1.00 0.00 H new ATOM 0 HB3 MET A 33 -8.665 1.535 6.007 1.00 0.00 H new ATOM 0 HG2 MET A 33 -7.839 3.610 5.588 1.00 0.00 H new ATOM 0 HG3 MET A 33 -7.659 3.825 7.318 1.00 0.00 H new ATOM 0 HE1 MET A 33 -4.759 1.724 4.624 1.00 0.00 H new ATOM 0 HE2 MET A 33 -6.431 2.230 4.286 1.00 0.00 H new ATOM 0 HE3 MET A 33 -5.082 3.347 3.971 1.00 0.00 H new ATOM 483 N GLY A 34 -10.635 1.508 7.345 1.00 0.00 N ATOM 484 CA GLY A 34 -12.046 1.856 7.320 1.00 0.00 C ATOM 485 C GLY A 34 -12.394 2.639 6.053 1.00 0.00 C ATOM 486 O GLY A 34 -11.505 3.061 5.315 1.00 0.00 O ATOM 0 H GLY A 34 -10.348 0.838 6.631 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.649 0.949 7.369 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.293 2.451 8.199 1.00 0.00 H new ATOM 490 N THR A 35 -13.691 2.809 5.839 1.00 0.00 N ATOM 491 CA THR A 35 -14.168 3.534 4.673 1.00 0.00 C ATOM 492 C THR A 35 -13.662 4.978 4.699 1.00 0.00 C ATOM 493 O THR A 35 -12.974 5.415 3.778 1.00 0.00 O ATOM 494 CB THR A 35 -15.694 3.425 4.641 1.00 0.00 C ATOM 495 OG1 THR A 35 -15.938 2.053 4.343 1.00 0.00 O ATOM 496 CG2 THR A 35 -16.310 4.178 3.460 1.00 0.00 C ATOM 0 H THR A 35 -14.426 2.457 6.453 1.00 0.00 H new ATOM 0 HA THR A 35 -13.777 3.103 3.751 1.00 0.00 H new ATOM 0 HB THR A 35 -16.105 3.813 5.573 1.00 0.00 H new ATOM 0 HG1 THR A 35 -16.904 1.893 4.305 1.00 0.00 H new ATOM 0 HG21 THR A 35 -17.394 4.068 3.484 1.00 0.00 H new ATOM 0 HG22 THR A 35 -16.050 5.235 3.527 1.00 0.00 H new ATOM 0 HG23 THR A 35 -15.925 3.768 2.526 1.00 0.00 H new ATOM 504 N THR A 36 -14.023 5.679 5.764 1.00 0.00 N ATOM 505 CA THR A 36 -13.614 7.064 5.923 1.00 0.00 C ATOM 506 C THR A 36 -12.176 7.254 5.437 1.00 0.00 C ATOM 507 O THR A 36 -11.944 7.875 4.401 1.00 0.00 O ATOM 508 CB THR A 36 -13.818 7.453 7.388 1.00 0.00 C ATOM 509 OG1 THR A 36 -15.212 7.255 7.610 1.00 0.00 O ATOM 510 CG2 THR A 36 -13.611 8.949 7.631 1.00 0.00 C ATOM 0 H THR A 36 -14.595 5.313 6.526 1.00 0.00 H new ATOM 0 HA THR A 36 -14.221 7.729 5.309 1.00 0.00 H new ATOM 0 HB THR A 36 -13.129 6.885 8.013 1.00 0.00 H new ATOM 0 HG1 THR A 36 -15.431 7.483 8.538 1.00 0.00 H new ATOM 0 HG21 THR A 36 -13.768 9.171 8.687 1.00 0.00 H new ATOM 0 HG22 THR A 36 -12.595 9.226 7.349 1.00 0.00 H new ATOM 0 HG23 THR A 36 -14.322 9.517 7.031 1.00 0.00 H new ATOM 518 N ARG A 37 -11.248 6.709 6.210 1.00 0.00 N ATOM 519 CA ARG A 37 -9.838 6.811 5.872 1.00 0.00 C ATOM 520 C ARG A 37 -9.593 6.290 4.455 1.00 0.00 C ATOM 521 O ARG A 37 -9.128 7.030 3.589 1.00 0.00 O ATOM 522 CB ARG A 37 -8.977 6.017 6.856 1.00 0.00 C ATOM 523 CG ARG A 37 -8.295 6.947 7.862 1.00 0.00 C ATOM 524 CD ARG A 37 -6.815 6.592 8.021 1.00 0.00 C ATOM 525 NE ARG A 37 -6.193 7.464 9.043 1.00 0.00 N ATOM 526 CZ ARG A 37 -4.889 7.446 9.352 1.00 0.00 C ATOM 527 NH1 ARG A 37 -4.062 6.601 8.720 1.00 0.00 N ATOM 528 NH2 ARG A 37 -4.412 8.272 10.292 1.00 0.00 N ATOM 0 H ARG A 37 -11.445 6.195 7.069 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.559 7.863 5.929 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.597 5.294 7.386 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.223 5.450 6.310 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -8.391 7.981 7.530 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.796 6.874 8.827 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.712 5.547 8.312 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.300 6.710 7.068 1.00 0.00 H new ATOM 0 HE ARG A 37 -6.794 8.119 9.543 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -4.425 5.972 8.004 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -3.070 6.587 8.955 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -5.041 8.915 10.773 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -3.420 8.258 10.527 1.00 0.00 H new ATOM 542 N ARG A 38 -9.917 5.020 4.262 1.00 0.00 N ATOM 543 CA ARG A 38 -9.737 4.390 2.964 1.00 0.00 C ATOM 544 C ARG A 38 -10.136 5.356 1.847 1.00 0.00 C ATOM 545 O ARG A 38 -9.325 5.677 0.979 1.00 0.00 O ATOM 546 CB ARG A 38 -10.575 3.115 2.850 1.00 0.00 C ATOM 547 CG ARG A 38 -10.588 2.595 1.411 1.00 0.00 C ATOM 548 CD ARG A 38 -11.092 1.151 1.355 1.00 0.00 C ATOM 549 NE ARG A 38 -11.500 0.811 -0.027 1.00 0.00 N ATOM 550 CZ ARG A 38 -12.720 1.047 -0.529 1.00 0.00 C ATOM 551 NH1 ARG A 38 -13.658 1.625 0.233 1.00 0.00 N ATOM 552 NH2 ARG A 38 -13.001 0.705 -1.794 1.00 0.00 N ATOM 0 H ARG A 38 -10.303 4.410 4.982 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.684 4.128 2.865 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -10.172 2.350 3.513 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -11.595 3.315 3.177 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -11.225 3.231 0.796 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.584 2.650 0.991 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.309 0.471 1.690 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.936 1.025 2.034 1.00 0.00 H new ATOM 0 HE ARG A 38 -10.810 0.370 -0.635 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.444 1.886 1.196 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.586 1.804 -0.149 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -12.287 0.265 -2.374 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.929 0.884 -2.177 1.00 0.00 H new ATOM 566 N ALA A 39 -11.386 5.792 1.903 1.00 0.00 N ATOM 567 CA ALA A 39 -11.902 6.715 0.906 1.00 0.00 C ATOM 568 C ALA A 39 -11.122 8.029 0.981 1.00 0.00 C ATOM 569 O ALA A 39 -10.558 8.477 -0.016 1.00 0.00 O ATOM 570 CB ALA A 39 -13.403 6.915 1.124 1.00 0.00 C ATOM 0 H ALA A 39 -12.057 5.523 2.623 1.00 0.00 H new ATOM 0 HA ALA A 39 -11.769 6.310 -0.097 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -13.790 7.607 0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -13.915 5.957 1.031 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -13.575 7.323 2.120 1.00 0.00 H new ATOM 576 N LEU A 40 -11.116 8.609 2.172 1.00 0.00 N ATOM 577 CA LEU A 40 -10.414 9.863 2.390 1.00 0.00 C ATOM 578 C LEU A 40 -9.059 9.814 1.682 1.00 0.00 C ATOM 579 O LEU A 40 -8.851 10.502 0.684 1.00 0.00 O ATOM 580 CB LEU A 40 -10.315 10.169 3.886 1.00 0.00 C ATOM 581 CG LEU A 40 -9.734 11.535 4.254 1.00 0.00 C ATOM 582 CD1 LEU A 40 -9.892 12.527 3.100 1.00 0.00 C ATOM 583 CD2 LEU A 40 -10.352 12.062 5.551 1.00 0.00 C ATOM 0 H LEU A 40 -11.586 8.234 2.996 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.972 10.692 1.955 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.312 10.092 4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.703 9.398 4.355 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.665 11.415 4.432 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -9.471 13.490 3.388 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.368 12.150 2.222 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.950 12.649 2.867 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.922 13.034 5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.430 12.163 5.426 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.145 11.364 6.362 1.00 0.00 H new ATOM 595 N LEU A 41 -8.172 8.993 2.226 1.00 0.00 N ATOM 596 CA LEU A 41 -6.843 8.845 1.658 1.00 0.00 C ATOM 597 C LEU A 41 -6.955 8.696 0.139 1.00 0.00 C ATOM 598 O LEU A 41 -6.345 9.458 -0.609 1.00 0.00 O ATOM 599 CB LEU A 41 -6.096 7.694 2.335 1.00 0.00 C ATOM 600 CG LEU A 41 -5.502 7.998 3.712 1.00 0.00 C ATOM 601 CD1 LEU A 41 -4.597 9.230 3.659 1.00 0.00 C ATOM 602 CD2 LEU A 41 -6.602 8.140 4.765 1.00 0.00 C ATOM 0 H LEU A 41 -8.348 8.424 3.054 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.247 9.737 1.848 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.780 6.852 2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.289 7.373 1.676 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.880 7.154 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.188 9.424 4.651 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.781 9.052 2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.176 10.093 3.330 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.152 8.356 5.734 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.270 8.955 4.486 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.169 7.211 4.827 1.00 0.00 H new ATOM 614 N MET A 42 -7.738 7.709 -0.270 1.00 0.00 N ATOM 615 CA MET A 42 -7.938 7.451 -1.686 1.00 0.00 C ATOM 616 C MET A 42 -8.308 8.735 -2.431 1.00 0.00 C ATOM 617 O MET A 42 -7.853 8.961 -3.551 1.00 0.00 O ATOM 618 CB MET A 42 -9.052 6.418 -1.864 1.00 0.00 C ATOM 619 CG MET A 42 -8.509 4.995 -1.717 1.00 0.00 C ATOM 620 SD MET A 42 -9.831 3.880 -1.273 1.00 0.00 S ATOM 621 CE MET A 42 -11.157 4.565 -2.253 1.00 0.00 C ATOM 0 H MET A 42 -8.241 7.078 0.354 1.00 0.00 H new ATOM 0 HA MET A 42 -7.006 7.069 -2.102 1.00 0.00 H new ATOM 0 HB2 MET A 42 -9.834 6.591 -1.125 1.00 0.00 H new ATOM 0 HB3 MET A 42 -9.509 6.537 -2.846 1.00 0.00 H new ATOM 0 HG2 MET A 42 -8.050 4.674 -2.652 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.730 4.971 -0.955 1.00 0.00 H new ATOM 0 HE1 MET A 42 -12.004 3.879 -2.249 1.00 0.00 H new ATOM 0 HE2 MET A 42 -11.464 5.522 -1.832 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.814 4.712 -3.277 1.00 0.00 H new ATOM 631 N GLU A 43 -9.131 9.543 -1.779 1.00 0.00 N ATOM 632 CA GLU A 43 -9.568 10.799 -2.365 1.00 0.00 C ATOM 633 C GLU A 43 -8.429 11.821 -2.339 1.00 0.00 C ATOM 634 O GLU A 43 -8.277 12.610 -3.271 1.00 0.00 O ATOM 635 CB GLU A 43 -10.806 11.339 -1.647 1.00 0.00 C ATOM 636 CG GLU A 43 -10.862 12.866 -1.722 1.00 0.00 C ATOM 637 CD GLU A 43 -12.239 13.385 -1.304 1.00 0.00 C ATOM 638 OE1 GLU A 43 -13.195 13.140 -2.071 1.00 0.00 O ATOM 639 OE2 GLU A 43 -12.304 14.017 -0.227 1.00 0.00 O ATOM 0 H GLU A 43 -9.507 9.352 -0.850 1.00 0.00 H new ATOM 0 HA GLU A 43 -9.843 10.616 -3.404 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -11.705 10.916 -2.096 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -10.792 11.023 -0.604 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -10.096 13.294 -1.075 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -10.639 13.192 -2.738 1.00 0.00 H new ATOM 646 N LEU A 44 -7.660 11.775 -1.262 1.00 0.00 N ATOM 647 CA LEU A 44 -6.540 12.687 -1.102 1.00 0.00 C ATOM 648 C LEU A 44 -5.531 12.451 -2.227 1.00 0.00 C ATOM 649 O LEU A 44 -5.062 13.399 -2.854 1.00 0.00 O ATOM 650 CB LEU A 44 -5.940 12.558 0.300 1.00 0.00 C ATOM 651 CG LEU A 44 -6.853 12.960 1.460 1.00 0.00 C ATOM 652 CD1 LEU A 44 -6.058 13.655 2.567 1.00 0.00 C ATOM 653 CD2 LEU A 44 -8.020 13.818 0.967 1.00 0.00 C ATOM 0 H LEU A 44 -7.790 11.120 -0.491 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.875 13.721 -1.186 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.632 11.523 0.448 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.038 13.168 0.345 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.279 12.054 1.890 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.730 13.931 3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.291 12.978 2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.585 14.552 2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.654 14.090 1.811 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.634 14.722 0.497 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -8.605 13.254 0.241 1.00 0.00 H new ATOM 665 N ALA A 45 -5.226 11.180 -2.449 1.00 0.00 N ATOM 666 CA ALA A 45 -4.281 10.808 -3.487 1.00 0.00 C ATOM 667 C ALA A 45 -4.776 11.336 -4.835 1.00 0.00 C ATOM 668 O ALA A 45 -4.004 11.904 -5.605 1.00 0.00 O ATOM 669 CB ALA A 45 -4.097 9.289 -3.489 1.00 0.00 C ATOM 0 H ALA A 45 -5.617 10.396 -1.927 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.306 11.255 -3.296 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.388 9.009 -4.268 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.717 8.967 -2.520 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -5.055 8.807 -3.681 1.00 0.00 H new ATOM 675 N ARG A 46 -6.062 11.130 -5.079 1.00 0.00 N ATOM 676 CA ARG A 46 -6.670 11.579 -6.320 1.00 0.00 C ATOM 677 C ARG A 46 -6.486 13.089 -6.486 1.00 0.00 C ATOM 678 O ARG A 46 -6.199 13.566 -7.582 1.00 0.00 O ATOM 679 CB ARG A 46 -8.163 11.247 -6.354 1.00 0.00 C ATOM 680 CG ARG A 46 -8.401 9.849 -6.930 1.00 0.00 C ATOM 681 CD ARG A 46 -9.875 9.454 -6.817 1.00 0.00 C ATOM 682 NE ARG A 46 -10.410 9.108 -8.153 1.00 0.00 N ATOM 683 CZ ARG A 46 -10.852 10.009 -9.041 1.00 0.00 C ATOM 684 NH1 ARG A 46 -10.827 11.315 -8.740 1.00 0.00 N ATOM 685 NH2 ARG A 46 -11.321 9.604 -10.229 1.00 0.00 N ATOM 0 H ARG A 46 -6.700 10.658 -4.438 1.00 0.00 H new ATOM 0 HA ARG A 46 -6.175 11.057 -7.139 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -8.575 11.304 -5.346 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -8.690 11.987 -6.956 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -8.093 9.825 -7.975 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.784 9.123 -6.400 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -9.982 8.605 -6.142 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.448 10.276 -6.388 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.444 8.123 -8.414 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -10.471 11.623 -7.835 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -11.163 12.001 -9.416 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -11.342 8.610 -10.457 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -11.658 10.290 -10.905 1.00 0.00 H new ATOM 699 N ARG A 47 -6.660 13.798 -5.381 1.00 0.00 N ATOM 700 CA ARG A 47 -6.517 15.244 -5.390 1.00 0.00 C ATOM 701 C ARG A 47 -5.111 15.636 -5.848 1.00 0.00 C ATOM 702 O ARG A 47 -4.892 16.757 -6.303 1.00 0.00 O ATOM 703 CB ARG A 47 -6.775 15.832 -4.001 1.00 0.00 C ATOM 704 CG ARG A 47 -8.266 15.801 -3.661 1.00 0.00 C ATOM 705 CD ARG A 47 -8.554 16.591 -2.382 1.00 0.00 C ATOM 706 NE ARG A 47 -9.034 17.948 -2.723 1.00 0.00 N ATOM 707 CZ ARG A 47 -9.363 18.879 -1.817 1.00 0.00 C ATOM 708 NH1 ARG A 47 -9.265 18.604 -0.509 1.00 0.00 N ATOM 709 NH2 ARG A 47 -9.789 20.084 -2.218 1.00 0.00 N ATOM 0 H ARG A 47 -6.899 13.398 -4.473 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.255 15.645 -6.085 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -6.216 15.268 -3.254 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -6.411 16.859 -3.963 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.840 16.219 -4.488 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.593 14.769 -3.536 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.303 16.071 -1.784 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.651 16.658 -1.775 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.120 18.190 -3.710 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.940 17.687 -0.204 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -9.515 19.312 0.181 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -9.863 20.293 -3.214 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -10.039 20.792 -1.528 1.00 0.00 H new ATOM 723 N LYS A 48 -4.194 14.689 -5.712 1.00 0.00 N ATOM 724 CA LYS A 48 -2.814 14.921 -6.107 1.00 0.00 C ATOM 725 C LYS A 48 -2.677 14.703 -7.615 1.00 0.00 C ATOM 726 O LYS A 48 -1.789 15.272 -8.249 1.00 0.00 O ATOM 727 CB LYS A 48 -1.866 14.059 -5.272 1.00 0.00 C ATOM 728 CG LYS A 48 -1.931 14.446 -3.793 1.00 0.00 C ATOM 729 CD LYS A 48 -1.425 15.874 -3.577 1.00 0.00 C ATOM 730 CE LYS A 48 -1.174 16.148 -2.093 1.00 0.00 C ATOM 731 NZ LYS A 48 -0.456 17.430 -1.918 1.00 0.00 N ATOM 0 H LYS A 48 -4.379 13.760 -5.334 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.528 15.954 -5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.128 13.007 -5.388 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.846 14.176 -5.637 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -2.958 14.362 -3.436 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -1.332 13.751 -3.205 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -0.504 16.026 -4.139 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.155 16.585 -3.963 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.123 16.179 -1.557 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.590 15.335 -1.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.293 17.601 -0.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.458 17.387 -2.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -1.027 18.204 -2.313 1.00 0.00 H new ATOM 745 N GLY A 49 -3.568 13.878 -8.145 1.00 0.00 N ATOM 746 CA GLY A 49 -3.557 13.578 -9.567 1.00 0.00 C ATOM 747 C GLY A 49 -3.341 12.083 -9.810 1.00 0.00 C ATOM 748 O GLY A 49 -3.297 11.637 -10.955 1.00 0.00 O ATOM 0 H GLY A 49 -4.302 13.408 -7.615 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.500 13.891 -10.016 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -2.767 14.148 -10.056 1.00 0.00 H new ATOM 752 N PHE A 50 -3.214 11.350 -8.714 1.00 0.00 N ATOM 753 CA PHE A 50 -3.005 9.914 -8.793 1.00 0.00 C ATOM 754 C PHE A 50 -4.273 9.201 -9.265 1.00 0.00 C ATOM 755 O PHE A 50 -5.370 9.749 -9.170 1.00 0.00 O ATOM 756 CB PHE A 50 -2.659 9.434 -7.383 1.00 0.00 C ATOM 757 CG PHE A 50 -1.163 9.470 -7.062 1.00 0.00 C ATOM 758 CD1 PHE A 50 -0.280 8.816 -7.863 1.00 0.00 C ATOM 759 CD2 PHE A 50 -0.717 10.157 -5.976 1.00 0.00 C ATOM 760 CE1 PHE A 50 1.108 8.850 -7.566 1.00 0.00 C ATOM 761 CE2 PHE A 50 0.672 10.191 -5.679 1.00 0.00 C ATOM 762 CZ PHE A 50 1.555 9.536 -6.481 1.00 0.00 C ATOM 0 H PHE A 50 -3.252 11.724 -7.766 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.210 9.692 -9.505 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -3.190 10.052 -6.659 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -3.022 8.414 -7.258 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -0.634 8.271 -8.725 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.418 10.676 -5.340 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.809 8.331 -8.203 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.027 10.736 -4.817 1.00 0.00 H new ATOM 0 HZ PHE A 50 2.611 9.561 -6.255 1.00 0.00 H new ATOM 772 N ARG A 51 -4.081 7.989 -9.765 1.00 0.00 N ATOM 773 CA ARG A 51 -5.196 7.195 -10.252 1.00 0.00 C ATOM 774 C ARG A 51 -5.605 6.156 -9.206 1.00 0.00 C ATOM 775 O ARG A 51 -5.279 4.977 -9.335 1.00 0.00 O ATOM 776 CB ARG A 51 -4.835 6.480 -11.556 1.00 0.00 C ATOM 777 CG ARG A 51 -6.027 5.687 -12.095 1.00 0.00 C ATOM 778 CD ARG A 51 -5.682 5.014 -13.425 1.00 0.00 C ATOM 779 NE ARG A 51 -6.518 5.576 -14.509 1.00 0.00 N ATOM 780 CZ ARG A 51 -6.461 5.176 -15.786 1.00 0.00 C ATOM 781 NH1 ARG A 51 -5.606 4.209 -16.148 1.00 0.00 N ATOM 782 NH2 ARG A 51 -7.258 5.743 -16.702 1.00 0.00 N ATOM 0 H ARG A 51 -3.170 7.538 -9.843 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.028 7.873 -10.441 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.514 7.211 -12.299 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -3.994 5.808 -11.386 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -6.325 4.932 -11.368 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.880 6.352 -12.231 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -4.627 5.163 -13.654 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.844 3.939 -13.350 1.00 0.00 H new ATOM 0 HE ARG A 51 -7.179 6.314 -14.269 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.999 3.778 -15.451 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.563 3.904 -17.120 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -7.908 6.479 -16.427 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.215 5.438 -17.674 1.00 0.00 H new ATOM 796 N VAL A 52 -6.314 6.632 -8.192 1.00 0.00 N ATOM 797 CA VAL A 52 -6.771 5.759 -7.124 1.00 0.00 C ATOM 798 C VAL A 52 -8.023 5.010 -7.584 1.00 0.00 C ATOM 799 O VAL A 52 -8.754 5.488 -8.450 1.00 0.00 O ATOM 800 CB VAL A 52 -6.995 6.570 -5.846 1.00 0.00 C ATOM 801 CG1 VAL A 52 -7.234 5.649 -4.648 1.00 0.00 C ATOM 802 CG2 VAL A 52 -5.823 7.517 -5.585 1.00 0.00 C ATOM 0 H VAL A 52 -6.583 7.610 -8.088 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.013 5.012 -6.890 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.890 7.176 -5.986 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.390 6.250 -3.752 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.116 5.035 -4.831 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -6.366 5.005 -4.506 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.008 8.081 -4.671 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -4.906 6.939 -5.475 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -5.719 8.207 -6.423 1.00 0.00 H new ATOM 812 N GLU A 53 -8.232 3.847 -6.985 1.00 0.00 N ATOM 813 CA GLU A 53 -9.383 3.027 -7.322 1.00 0.00 C ATOM 814 C GLU A 53 -10.179 2.685 -6.061 1.00 0.00 C ATOM 815 O GLU A 53 -9.707 2.902 -4.947 1.00 0.00 O ATOM 816 CB GLU A 53 -8.954 1.757 -8.061 1.00 0.00 C ATOM 817 CG GLU A 53 -8.255 2.099 -9.378 1.00 0.00 C ATOM 818 CD GLU A 53 -9.274 2.341 -10.493 1.00 0.00 C ATOM 819 OE1 GLU A 53 -10.210 3.132 -10.245 1.00 0.00 O ATOM 820 OE2 GLU A 53 -9.095 1.729 -11.568 1.00 0.00 O ATOM 0 H GLU A 53 -7.623 3.453 -6.268 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.027 3.597 -7.991 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.283 1.174 -7.430 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.827 1.135 -8.259 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -7.637 2.987 -9.246 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.587 1.286 -9.661 1.00 0.00 H new ATOM 827 N ASN A 54 -11.373 2.155 -6.280 1.00 0.00 N ATOM 828 CA ASN A 54 -12.240 1.781 -5.175 1.00 0.00 C ATOM 829 C ASN A 54 -12.292 0.255 -5.068 1.00 0.00 C ATOM 830 O ASN A 54 -12.696 -0.285 -4.039 1.00 0.00 O ATOM 831 CB ASN A 54 -13.666 2.288 -5.397 1.00 0.00 C ATOM 832 CG ASN A 54 -13.901 3.605 -4.654 1.00 0.00 C ATOM 833 OD1 ASN A 54 -13.784 4.688 -5.204 1.00 0.00 O ATOM 834 ND2 ASN A 54 -14.238 3.452 -3.376 1.00 0.00 N ATOM 0 H ASN A 54 -11.761 1.975 -7.206 1.00 0.00 H new ATOM 0 HA ASN A 54 -11.837 2.226 -4.265 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -13.843 2.431 -6.463 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -14.380 1.540 -5.053 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -14.416 4.271 -2.794 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -14.318 2.516 -2.978 1.00 0.00 H new ATOM 841 N GLU A 55 -11.878 -0.397 -6.144 1.00 0.00 N ATOM 842 CA GLU A 55 -11.873 -1.849 -6.184 1.00 0.00 C ATOM 843 C GLU A 55 -10.576 -2.358 -6.816 1.00 0.00 C ATOM 844 O GLU A 55 -10.032 -1.726 -7.720 1.00 0.00 O ATOM 845 CB GLU A 55 -13.095 -2.381 -6.936 1.00 0.00 C ATOM 846 CG GLU A 55 -14.392 -1.954 -6.246 1.00 0.00 C ATOM 847 CD GLU A 55 -15.596 -2.158 -7.169 1.00 0.00 C ATOM 848 OE1 GLU A 55 -15.478 -1.768 -8.350 1.00 0.00 O ATOM 849 OE2 GLU A 55 -16.607 -2.699 -6.671 1.00 0.00 O ATOM 0 H GLU A 55 -11.543 0.054 -6.995 1.00 0.00 H new ATOM 0 HA GLU A 55 -11.926 -2.221 -5.161 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.085 -2.011 -7.961 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -13.048 -3.469 -6.990 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.529 -2.531 -5.331 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -14.326 -0.906 -5.955 1.00 0.00 H new ATOM 856 N LEU A 56 -10.118 -3.496 -6.315 1.00 0.00 N ATOM 857 CA LEU A 56 -8.895 -4.097 -6.818 1.00 0.00 C ATOM 858 C LEU A 56 -9.113 -4.551 -8.263 1.00 0.00 C ATOM 859 O LEU A 56 -10.016 -5.339 -8.541 1.00 0.00 O ATOM 860 CB LEU A 56 -8.425 -5.216 -5.887 1.00 0.00 C ATOM 861 CG LEU A 56 -7.022 -5.766 -6.153 1.00 0.00 C ATOM 862 CD1 LEU A 56 -7.029 -7.295 -6.186 1.00 0.00 C ATOM 863 CD2 LEU A 56 -6.433 -5.167 -7.432 1.00 0.00 C ATOM 0 H LEU A 56 -10.572 -4.018 -5.566 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.088 -3.365 -6.831 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.461 -4.847 -4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.135 -6.040 -5.954 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.375 -5.466 -5.329 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.020 -7.659 -6.377 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.378 -7.678 -5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.694 -7.639 -6.978 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.436 -5.574 -7.599 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.073 -5.416 -8.279 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.371 -4.083 -7.331 1.00 0.00 H new ATOM 875 N SER A 57 -8.270 -4.034 -9.145 1.00 0.00 N ATOM 876 CA SER A 57 -8.358 -4.376 -10.555 1.00 0.00 C ATOM 877 C SER A 57 -6.977 -4.761 -11.088 1.00 0.00 C ATOM 878 O SER A 57 -5.993 -4.735 -10.349 1.00 0.00 O ATOM 879 CB SER A 57 -8.937 -3.216 -11.368 1.00 0.00 C ATOM 880 OG SER A 57 -10.354 -3.301 -11.485 1.00 0.00 O ATOM 0 H SER A 57 -7.523 -3.381 -8.911 1.00 0.00 H new ATOM 0 HA SER A 57 -9.030 -5.228 -10.659 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.668 -2.272 -10.894 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.491 -3.212 -12.362 1.00 0.00 H new ATOM 0 HG SER A 57 -10.685 -2.542 -12.009 1.00 0.00 H new ATOM 886 N ASP A 58 -6.947 -5.110 -12.365 1.00 0.00 N ATOM 887 CA ASP A 58 -5.702 -5.500 -13.006 1.00 0.00 C ATOM 888 C ASP A 58 -4.880 -4.248 -13.318 1.00 0.00 C ATOM 889 O ASP A 58 -3.709 -4.345 -13.682 1.00 0.00 O ATOM 890 CB ASP A 58 -5.966 -6.233 -14.323 1.00 0.00 C ATOM 891 CG ASP A 58 -4.874 -6.073 -15.382 1.00 0.00 C ATOM 892 OD1 ASP A 58 -3.702 -6.335 -15.032 1.00 0.00 O ATOM 893 OD2 ASP A 58 -5.234 -5.693 -16.516 1.00 0.00 O ATOM 0 H ASP A 58 -7.765 -5.131 -12.974 1.00 0.00 H new ATOM 0 HA ASP A 58 -5.166 -6.162 -12.326 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.093 -7.295 -14.111 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.909 -5.876 -14.738 1.00 0.00 H new ATOM 898 N SER A 59 -5.526 -3.102 -13.163 1.00 0.00 N ATOM 899 CA SER A 59 -4.869 -1.832 -13.424 1.00 0.00 C ATOM 900 C SER A 59 -4.110 -1.370 -12.178 1.00 0.00 C ATOM 901 O SER A 59 -3.284 -0.462 -12.252 1.00 0.00 O ATOM 902 CB SER A 59 -5.880 -0.767 -13.855 1.00 0.00 C ATOM 903 OG SER A 59 -5.869 -0.561 -15.265 1.00 0.00 O ATOM 0 H SER A 59 -6.497 -3.026 -12.860 1.00 0.00 H new ATOM 0 HA SER A 59 -4.162 -1.974 -14.241 1.00 0.00 H new ATOM 0 HB2 SER A 59 -6.879 -1.067 -13.540 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.655 0.172 -13.349 1.00 0.00 H new ATOM 0 HG SER A 59 -6.529 0.124 -15.501 1.00 0.00 H new ATOM 909 N VAL A 60 -4.419 -2.016 -11.063 1.00 0.00 N ATOM 910 CA VAL A 60 -3.776 -1.682 -9.803 1.00 0.00 C ATOM 911 C VAL A 60 -2.311 -2.120 -9.851 1.00 0.00 C ATOM 912 O VAL A 60 -2.019 -3.309 -9.970 1.00 0.00 O ATOM 913 CB VAL A 60 -4.550 -2.307 -8.640 1.00 0.00 C ATOM 914 CG1 VAL A 60 -3.756 -2.203 -7.336 1.00 0.00 C ATOM 915 CG2 VAL A 60 -5.931 -1.666 -8.494 1.00 0.00 C ATOM 0 H VAL A 60 -5.105 -2.768 -11.006 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.787 -0.604 -9.642 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.694 -3.365 -8.862 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.328 -2.654 -6.525 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.806 -2.726 -7.446 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.568 -1.154 -7.107 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.460 -2.128 -7.661 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.818 -0.598 -8.305 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.500 -1.814 -9.412 1.00 0.00 H new ATOM 925 N THR A 61 -1.429 -1.137 -9.756 1.00 0.00 N ATOM 926 CA THR A 61 -0.001 -1.406 -9.787 1.00 0.00 C ATOM 927 C THR A 61 0.606 -1.225 -8.394 1.00 0.00 C ATOM 928 O THR A 61 1.695 -1.724 -8.118 1.00 0.00 O ATOM 929 CB THR A 61 0.628 -0.499 -10.846 1.00 0.00 C ATOM 930 OG1 THR A 61 0.479 0.814 -10.313 1.00 0.00 O ATOM 931 CG2 THR A 61 -0.181 -0.467 -12.145 1.00 0.00 C ATOM 0 H THR A 61 -1.675 -0.152 -9.657 1.00 0.00 H new ATOM 0 HA THR A 61 0.201 -2.441 -10.063 1.00 0.00 H new ATOM 0 HB THR A 61 1.642 -0.838 -11.057 1.00 0.00 H new ATOM 0 HG1 THR A 61 0.584 0.785 -9.339 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.309 0.191 -12.863 1.00 0.00 H new ATOM 0 HG22 THR A 61 -0.244 -1.473 -12.559 1.00 0.00 H new ATOM 0 HG23 THR A 61 -1.185 -0.096 -11.939 1.00 0.00 H new ATOM 939 N HIS A 62 -0.126 -0.509 -7.553 1.00 0.00 N ATOM 940 CA HIS A 62 0.326 -0.256 -6.196 1.00 0.00 C ATOM 941 C HIS A 62 -0.854 -0.378 -5.230 1.00 0.00 C ATOM 942 O HIS A 62 -1.876 0.283 -5.407 1.00 0.00 O ATOM 943 CB HIS A 62 1.032 1.098 -6.102 1.00 0.00 C ATOM 944 CG HIS A 62 1.939 1.401 -7.271 1.00 0.00 C ATOM 945 ND1 HIS A 62 1.531 2.146 -8.363 1.00 0.00 N ATOM 946 CD2 HIS A 62 3.236 1.051 -7.505 1.00 0.00 C ATOM 947 CE1 HIS A 62 2.545 2.234 -9.211 1.00 0.00 C ATOM 948 NE2 HIS A 62 3.600 1.555 -8.678 1.00 0.00 N ATOM 0 H HIS A 62 -1.029 -0.096 -7.786 1.00 0.00 H new ATOM 0 HA HIS A 62 1.064 -1.006 -5.909 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.280 1.884 -6.026 1.00 0.00 H new ATOM 0 HB3 HIS A 62 1.618 1.127 -5.184 1.00 0.00 H new ATOM 0 HD2 HIS A 62 3.861 0.464 -6.848 1.00 0.00 H new ATOM 0 HE1 HIS A 62 2.537 2.753 -10.158 1.00 0.00 H new ATOM 0 HE2 HIS A 62 4.518 1.451 -9.110 1.00 0.00 H new ATOM 956 N ILE A 63 -0.673 -1.228 -4.229 1.00 0.00 N ATOM 957 CA ILE A 63 -1.711 -1.445 -3.235 1.00 0.00 C ATOM 958 C ILE A 63 -1.237 -0.905 -1.884 1.00 0.00 C ATOM 959 O ILE A 63 -0.206 -1.333 -1.368 1.00 0.00 O ATOM 960 CB ILE A 63 -2.119 -2.919 -3.200 1.00 0.00 C ATOM 961 CG1 ILE A 63 -3.026 -3.265 -4.383 1.00 0.00 C ATOM 962 CG2 ILE A 63 -2.763 -3.277 -1.859 1.00 0.00 C ATOM 963 CD1 ILE A 63 -3.268 -4.774 -4.465 1.00 0.00 C ATOM 0 H ILE A 63 0.176 -1.774 -4.085 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.614 -0.895 -3.500 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.219 -3.526 -3.297 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -3.979 -2.745 -4.280 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.571 -2.915 -5.310 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.044 -4.330 -1.860 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.053 -3.092 -1.053 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.652 -2.665 -1.707 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.915 -4.993 -5.314 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.316 -5.289 -4.593 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.745 -5.116 -3.547 1.00 0.00 H new ATOM 975 N VAL A 64 -2.013 0.026 -1.350 1.00 0.00 N ATOM 976 CA VAL A 64 -1.686 0.628 -0.069 1.00 0.00 C ATOM 977 C VAL A 64 -2.420 -0.122 1.045 1.00 0.00 C ATOM 978 O VAL A 64 -3.570 -0.524 0.874 1.00 0.00 O ATOM 979 CB VAL A 64 -2.009 2.123 -0.096 1.00 0.00 C ATOM 980 CG1 VAL A 64 -1.789 2.757 1.280 1.00 0.00 C ATOM 981 CG2 VAL A 64 -1.187 2.842 -1.168 1.00 0.00 C ATOM 0 H VAL A 64 -2.868 0.378 -1.781 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.618 0.543 0.131 1.00 0.00 H new ATOM 0 HB VAL A 64 -3.063 2.233 -0.351 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -2.026 3.820 1.233 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.436 2.273 2.011 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.748 2.630 1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.436 3.903 -1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.125 2.718 -0.956 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -1.414 2.418 -2.146 1.00 0.00 H new ATOM 991 N ALA A 65 -1.726 -0.287 2.161 1.00 0.00 N ATOM 992 CA ALA A 65 -2.297 -0.981 3.302 1.00 0.00 C ATOM 993 C ALA A 65 -1.680 -0.432 4.590 1.00 0.00 C ATOM 994 O ALA A 65 -0.550 0.055 4.582 1.00 0.00 O ATOM 995 CB ALA A 65 -2.077 -2.487 3.147 1.00 0.00 C ATOM 0 H ALA A 65 -0.773 0.048 2.299 1.00 0.00 H new ATOM 0 HA ALA A 65 -3.373 -0.812 3.354 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -2.506 -3.007 4.003 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.560 -2.833 2.233 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.008 -2.695 3.094 1.00 0.00 H new ATOM 1001 N GLU A 66 -2.448 -0.528 5.665 1.00 0.00 N ATOM 1002 CA GLU A 66 -1.990 -0.047 6.957 1.00 0.00 C ATOM 1003 C GLU A 66 -2.163 -1.134 8.020 1.00 0.00 C ATOM 1004 O GLU A 66 -3.147 -1.872 8.004 1.00 0.00 O ATOM 1005 CB GLU A 66 -2.726 1.233 7.357 1.00 0.00 C ATOM 1006 CG GLU A 66 -2.209 1.768 8.694 1.00 0.00 C ATOM 1007 CD GLU A 66 -3.195 2.768 9.303 1.00 0.00 C ATOM 1008 OE1 GLU A 66 -4.221 2.298 9.839 1.00 0.00 O ATOM 1009 OE2 GLU A 66 -2.899 3.979 9.219 1.00 0.00 O ATOM 0 H GLU A 66 -3.385 -0.932 5.668 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.929 0.192 6.879 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -2.594 1.989 6.583 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -3.795 1.034 7.430 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -2.052 0.940 9.385 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.242 2.249 8.548 1.00 0.00 H new ATOM 1016 N ASN A 67 -1.192 -1.198 8.919 1.00 0.00 N ATOM 1017 CA ASN A 67 -1.225 -2.182 9.987 1.00 0.00 C ATOM 1018 C ASN A 67 -1.301 -3.584 9.381 1.00 0.00 C ATOM 1019 O ASN A 67 -1.749 -4.524 10.036 1.00 0.00 O ATOM 1020 CB ASN A 67 -2.452 -1.986 10.880 1.00 0.00 C ATOM 1021 CG ASN A 67 -2.216 -0.869 11.899 1.00 0.00 C ATOM 1022 OD1 ASN A 67 -2.820 0.190 11.848 1.00 0.00 O ATOM 1023 ND2 ASN A 67 -1.306 -1.163 12.823 1.00 0.00 N ATOM 0 H ASN A 67 -0.377 -0.584 8.930 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.321 -2.061 10.584 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -3.319 -1.745 10.265 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -2.679 -2.916 11.401 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -1.076 -0.483 13.547 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -0.838 -2.069 12.807 1.00 0.00 H new ATOM 1030 N ASN A 68 -0.856 -3.681 8.136 1.00 0.00 N ATOM 1031 CA ASN A 68 -0.869 -4.953 7.434 1.00 0.00 C ATOM 1032 C ASN A 68 0.500 -5.189 6.792 1.00 0.00 C ATOM 1033 O ASN A 68 1.152 -4.246 6.346 1.00 0.00 O ATOM 1034 CB ASN A 68 -1.919 -4.958 6.322 1.00 0.00 C ATOM 1035 CG ASN A 68 -3.323 -5.165 6.895 1.00 0.00 C ATOM 1036 OD1 ASN A 68 -3.756 -6.274 7.159 1.00 0.00 O ATOM 1037 ND2 ASN A 68 -4.007 -4.038 7.071 1.00 0.00 N ATOM 0 H ASN A 68 -0.484 -2.899 7.596 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.105 -5.735 8.156 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -1.880 -4.015 5.776 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -1.694 -5.750 5.607 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.954 -4.070 7.448 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.584 -3.142 6.829 1.00 0.00 H new ATOM 1044 N SER A 69 0.895 -6.454 6.766 1.00 0.00 N ATOM 1045 CA SER A 69 2.175 -6.826 6.187 1.00 0.00 C ATOM 1046 C SER A 69 1.976 -7.313 4.750 1.00 0.00 C ATOM 1047 O SER A 69 0.944 -7.898 4.426 1.00 0.00 O ATOM 1048 CB SER A 69 2.865 -7.906 7.022 1.00 0.00 C ATOM 1049 OG SER A 69 2.881 -7.579 8.409 1.00 0.00 O ATOM 0 H SER A 69 0.351 -7.234 7.136 1.00 0.00 H new ATOM 0 HA SER A 69 2.817 -5.945 6.181 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.352 -8.857 6.880 1.00 0.00 H new ATOM 0 HB3 SER A 69 3.888 -8.039 6.669 1.00 0.00 H new ATOM 0 HG SER A 69 3.328 -8.294 8.908 1.00 0.00 H new ATOM 1055 N GLY A 70 2.981 -7.053 3.927 1.00 0.00 N ATOM 1056 CA GLY A 70 2.930 -7.457 2.532 1.00 0.00 C ATOM 1057 C GLY A 70 2.296 -8.842 2.386 1.00 0.00 C ATOM 1058 O GLY A 70 1.677 -9.140 1.365 1.00 0.00 O ATOM 0 H GLY A 70 3.836 -6.567 4.199 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.357 -6.728 1.959 1.00 0.00 H new ATOM 0 HA3 GLY A 70 3.937 -7.468 2.116 1.00 0.00 H new ATOM 1062 N SER A 71 2.472 -9.650 3.420 1.00 0.00 N ATOM 1063 CA SER A 71 1.925 -10.997 3.419 1.00 0.00 C ATOM 1064 C SER A 71 0.404 -10.943 3.577 1.00 0.00 C ATOM 1065 O SER A 71 -0.325 -11.573 2.812 1.00 0.00 O ATOM 1066 CB SER A 71 2.544 -11.844 4.533 1.00 0.00 C ATOM 1067 OG SER A 71 2.527 -11.170 5.789 1.00 0.00 O ATOM 0 H SER A 71 2.986 -9.399 4.265 1.00 0.00 H new ATOM 0 HA SER A 71 2.169 -11.465 2.465 1.00 0.00 H new ATOM 0 HB2 SER A 71 1.999 -12.784 4.619 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.572 -12.094 4.270 1.00 0.00 H new ATOM 0 HG SER A 71 2.929 -11.744 6.474 1.00 0.00 H new ATOM 1073 N ASP A 72 -0.030 -10.185 4.573 1.00 0.00 N ATOM 1074 CA ASP A 72 -1.451 -10.042 4.841 1.00 0.00 C ATOM 1075 C ASP A 72 -2.155 -9.542 3.578 1.00 0.00 C ATOM 1076 O ASP A 72 -3.267 -9.969 3.272 1.00 0.00 O ATOM 1077 CB ASP A 72 -1.701 -9.024 5.955 1.00 0.00 C ATOM 1078 CG ASP A 72 -1.658 -9.595 7.374 1.00 0.00 C ATOM 1079 OD1 ASP A 72 -1.921 -10.810 7.505 1.00 0.00 O ATOM 1080 OD2 ASP A 72 -1.363 -8.804 8.296 1.00 0.00 O ATOM 0 H ASP A 72 0.578 -9.663 5.205 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.836 -11.014 5.147 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.957 -8.231 5.876 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.676 -8.564 5.794 1.00 0.00 H new ATOM 1085 N VAL A 73 -1.478 -8.644 2.877 1.00 0.00 N ATOM 1086 CA VAL A 73 -2.025 -8.082 1.654 1.00 0.00 C ATOM 1087 C VAL A 73 -2.012 -9.149 0.557 1.00 0.00 C ATOM 1088 O VAL A 73 -2.943 -9.233 -0.243 1.00 0.00 O ATOM 1089 CB VAL A 73 -1.252 -6.819 1.267 1.00 0.00 C ATOM 1090 CG1 VAL A 73 -1.766 -6.246 -0.055 1.00 0.00 C ATOM 1091 CG2 VAL A 73 -1.320 -5.773 2.382 1.00 0.00 C ATOM 0 H VAL A 73 -0.556 -8.292 3.133 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.062 -7.780 1.803 1.00 0.00 H new ATOM 0 HB VAL A 73 -0.206 -7.094 1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.200 -5.349 -0.307 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.643 -6.987 -0.845 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.822 -5.993 0.044 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -0.763 -4.885 2.082 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -2.360 -5.504 2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -0.885 -6.184 3.293 1.00 0.00 H new ATOM 1101 N LEU A 74 -0.948 -9.938 0.555 1.00 0.00 N ATOM 1102 CA LEU A 74 -0.802 -10.996 -0.430 1.00 0.00 C ATOM 1103 C LEU A 74 -1.957 -11.989 -0.280 1.00 0.00 C ATOM 1104 O LEU A 74 -2.770 -12.143 -1.190 1.00 0.00 O ATOM 1105 CB LEU A 74 0.581 -11.641 -0.323 1.00 0.00 C ATOM 1106 CG LEU A 74 1.630 -11.148 -1.321 1.00 0.00 C ATOM 1107 CD1 LEU A 74 3.038 -11.563 -0.887 1.00 0.00 C ATOM 1108 CD2 LEU A 74 1.304 -11.622 -2.739 1.00 0.00 C ATOM 0 H LEU A 74 -0.178 -9.866 1.220 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.860 -10.588 -1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.961 -11.474 0.685 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.468 -12.718 -0.447 1.00 0.00 H new ATOM 0 HG LEU A 74 1.605 -10.058 -1.332 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.765 -11.200 -1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.258 -11.135 0.091 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.095 -12.650 -0.829 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.065 -11.258 -3.429 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.284 -12.712 -2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 74 0.330 -11.235 -3.037 1.00 0.00 H new ATOM 1120 N GLU A 75 -1.992 -12.637 0.875 1.00 0.00 N ATOM 1121 CA GLU A 75 -3.034 -13.610 1.155 1.00 0.00 C ATOM 1122 C GLU A 75 -4.395 -13.076 0.706 1.00 0.00 C ATOM 1123 O GLU A 75 -5.212 -13.821 0.168 1.00 0.00 O ATOM 1124 CB GLU A 75 -3.053 -13.981 2.640 1.00 0.00 C ATOM 1125 CG GLU A 75 -1.718 -14.593 3.070 1.00 0.00 C ATOM 1126 CD GLU A 75 -1.925 -15.970 3.703 1.00 0.00 C ATOM 1127 OE1 GLU A 75 -2.134 -16.002 4.935 1.00 0.00 O ATOM 1128 OE2 GLU A 75 -1.869 -16.959 2.941 1.00 0.00 O ATOM 0 H GLU A 75 -1.316 -12.507 1.628 1.00 0.00 H new ATOM 0 HA GLU A 75 -2.818 -14.517 0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.259 -13.093 3.238 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.860 -14.688 2.831 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -1.059 -14.681 2.206 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.223 -13.932 3.782 1.00 0.00 H new ATOM 1135 N TRP A 76 -4.597 -11.788 0.943 1.00 0.00 N ATOM 1136 CA TRP A 76 -5.845 -11.145 0.570 1.00 0.00 C ATOM 1137 C TRP A 76 -5.910 -11.091 -0.958 1.00 0.00 C ATOM 1138 O TRP A 76 -6.950 -11.377 -1.549 1.00 0.00 O ATOM 1139 CB TRP A 76 -5.968 -9.766 1.222 1.00 0.00 C ATOM 1140 CG TRP A 76 -7.021 -8.864 0.575 1.00 0.00 C ATOM 1141 CD1 TRP A 76 -8.292 -8.675 0.955 1.00 0.00 C ATOM 1142 CD2 TRP A 76 -6.840 -8.028 -0.588 1.00 0.00 C ATOM 1143 NE1 TRP A 76 -8.941 -7.784 0.125 1.00 0.00 N ATOM 1144 CE2 TRP A 76 -8.030 -7.378 -0.842 1.00 0.00 C ATOM 1145 CE3 TRP A 76 -5.708 -7.829 -1.397 1.00 0.00 C ATOM 1146 CZ2 TRP A 76 -8.202 -6.485 -1.907 1.00 0.00 C ATOM 1147 CZ3 TRP A 76 -5.897 -6.934 -2.457 1.00 0.00 C ATOM 1148 CH2 TRP A 76 -7.088 -6.271 -2.727 1.00 0.00 C ATOM 0 H TRP A 76 -3.917 -11.172 1.389 1.00 0.00 H new ATOM 0 HA TRP A 76 -6.698 -11.717 0.936 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -6.213 -9.894 2.276 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -5.000 -9.267 1.178 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -8.751 -9.159 1.804 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -9.911 -7.480 0.206 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -4.767 -8.327 -1.215 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -9.144 -5.988 -2.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.058 -6.746 -3.111 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -7.154 -5.594 -3.566 1.00 0.00 H new ATOM 1159 N LEU A 77 -4.786 -10.722 -1.554 1.00 0.00 N ATOM 1160 CA LEU A 77 -4.703 -10.627 -3.002 1.00 0.00 C ATOM 1161 C LEU A 77 -5.321 -11.878 -3.627 1.00 0.00 C ATOM 1162 O LEU A 77 -6.187 -11.780 -4.495 1.00 0.00 O ATOM 1163 CB LEU A 77 -3.259 -10.370 -3.439 1.00 0.00 C ATOM 1164 CG LEU A 77 -3.059 -9.261 -4.474 1.00 0.00 C ATOM 1165 CD1 LEU A 77 -4.195 -9.256 -5.499 1.00 0.00 C ATOM 1166 CD2 LEU A 77 -2.895 -7.900 -3.795 1.00 0.00 C ATOM 0 H LEU A 77 -3.925 -10.485 -1.061 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.278 -9.774 -3.362 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.671 -10.125 -2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.853 -11.296 -3.845 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.136 -9.464 -5.017 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.028 -8.458 -6.223 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.223 -10.215 -6.016 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.144 -9.091 -4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.754 -7.130 -4.553 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.787 -7.675 -3.210 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.026 -7.924 -3.137 1.00 0.00 H new ATOM 1178 N GLN A 78 -4.853 -13.027 -3.161 1.00 0.00 N ATOM 1179 CA GLN A 78 -5.350 -14.297 -3.664 1.00 0.00 C ATOM 1180 C GLN A 78 -6.792 -14.521 -3.206 1.00 0.00 C ATOM 1181 O GLN A 78 -7.566 -15.192 -3.888 1.00 0.00 O ATOM 1182 CB GLN A 78 -4.448 -15.451 -3.223 1.00 0.00 C ATOM 1183 CG GLN A 78 -3.063 -15.341 -3.863 1.00 0.00 C ATOM 1184 CD GLN A 78 -2.592 -16.698 -4.390 1.00 0.00 C ATOM 1185 OE1 GLN A 78 -3.364 -17.503 -4.883 1.00 0.00 O ATOM 1186 NE2 GLN A 78 -1.285 -16.906 -4.258 1.00 0.00 N ATOM 0 H GLN A 78 -4.135 -13.105 -2.441 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.337 -14.265 -4.753 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.352 -15.447 -2.137 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.906 -16.401 -3.499 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -3.092 -14.620 -4.680 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.349 -14.964 -3.131 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -0.695 -16.189 -3.836 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -0.873 -17.782 -4.579 1.00 0.00 H new ATOM 1195 N ALA A 79 -7.110 -13.948 -2.055 1.00 0.00 N ATOM 1196 CA ALA A 79 -8.446 -14.077 -1.498 1.00 0.00 C ATOM 1197 C ALA A 79 -9.444 -13.357 -2.407 1.00 0.00 C ATOM 1198 O ALA A 79 -10.564 -13.828 -2.600 1.00 0.00 O ATOM 1199 CB ALA A 79 -8.459 -13.530 -0.070 1.00 0.00 C ATOM 0 H ALA A 79 -6.465 -13.393 -1.492 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.741 -15.125 -1.448 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -9.461 -13.627 0.348 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.755 -14.094 0.542 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.170 -12.479 -0.080 1.00 0.00 H new ATOM 1205 N GLN A 80 -9.002 -12.228 -2.942 1.00 0.00 N ATOM 1206 CA GLN A 80 -9.843 -11.439 -3.826 1.00 0.00 C ATOM 1207 C GLN A 80 -10.328 -12.293 -4.999 1.00 0.00 C ATOM 1208 O GLN A 80 -9.899 -13.435 -5.160 1.00 0.00 O ATOM 1209 CB GLN A 80 -9.103 -10.196 -4.321 1.00 0.00 C ATOM 1210 CG GLN A 80 -8.614 -9.345 -3.147 1.00 0.00 C ATOM 1211 CD GLN A 80 -9.623 -9.366 -1.997 1.00 0.00 C ATOM 1212 OE1 GLN A 80 -10.639 -8.691 -2.016 1.00 0.00 O ATOM 1213 NE2 GLN A 80 -9.286 -10.175 -0.997 1.00 0.00 N ATOM 0 H GLN A 80 -8.072 -11.841 -2.780 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.714 -11.102 -3.263 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.254 -10.495 -4.937 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.763 -9.603 -4.954 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -7.652 -9.719 -2.798 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -8.456 -8.319 -3.478 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.420 -10.712 -1.045 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -9.893 -10.258 -0.182 1.00 0.00 H new ATOM 1222 N LYS A 81 -11.215 -11.707 -5.790 1.00 0.00 N ATOM 1223 CA LYS A 81 -11.762 -12.399 -6.944 1.00 0.00 C ATOM 1224 C LYS A 81 -11.254 -11.731 -8.223 1.00 0.00 C ATOM 1225 O LYS A 81 -11.547 -12.189 -9.326 1.00 0.00 O ATOM 1226 CB LYS A 81 -13.288 -12.471 -6.852 1.00 0.00 C ATOM 1227 CG LYS A 81 -13.732 -12.947 -5.467 1.00 0.00 C ATOM 1228 CD LYS A 81 -14.961 -13.852 -5.567 1.00 0.00 C ATOM 1229 CE LYS A 81 -14.880 -15.001 -4.559 1.00 0.00 C ATOM 1230 NZ LYS A 81 -14.722 -16.295 -5.260 1.00 0.00 N ATOM 0 H LYS A 81 -11.568 -10.760 -5.654 1.00 0.00 H new ATOM 0 HA LYS A 81 -11.418 -13.433 -6.966 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.715 -11.489 -7.057 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -13.670 -13.150 -7.614 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.917 -13.487 -4.985 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.960 -12.086 -4.838 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.863 -13.268 -5.386 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -15.039 -14.254 -6.577 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.039 -14.842 -3.884 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -15.782 -15.020 -3.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.669 -17.064 -4.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.537 -16.452 -5.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.849 -16.279 -5.825 1.00 0.00 H new ATOM 1244 N VAL A 82 -10.500 -10.657 -8.032 1.00 0.00 N ATOM 1245 CA VAL A 82 -9.949 -9.921 -9.157 1.00 0.00 C ATOM 1246 C VAL A 82 -8.610 -10.542 -9.560 1.00 0.00 C ATOM 1247 O VAL A 82 -7.938 -11.164 -8.739 1.00 0.00 O ATOM 1248 CB VAL A 82 -9.837 -8.436 -8.806 1.00 0.00 C ATOM 1249 CG1 VAL A 82 -10.502 -8.139 -7.460 1.00 0.00 C ATOM 1250 CG2 VAL A 82 -8.376 -7.981 -8.808 1.00 0.00 C ATOM 0 H VAL A 82 -10.258 -10.280 -7.116 1.00 0.00 H new ATOM 0 HA VAL A 82 -10.612 -9.989 -10.020 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.365 -7.870 -9.573 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.408 -7.077 -7.234 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.557 -8.408 -7.508 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -10.015 -8.721 -6.677 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -8.324 -6.922 -8.556 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -7.814 -8.557 -8.073 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -7.947 -8.139 -9.797 1.00 0.00 H new ATOM 1260 N GLN A 83 -8.263 -10.353 -10.825 1.00 0.00 N ATOM 1261 CA GLN A 83 -7.017 -10.887 -11.347 1.00 0.00 C ATOM 1262 C GLN A 83 -6.123 -9.752 -11.851 1.00 0.00 C ATOM 1263 O GLN A 83 -6.588 -8.856 -12.554 1.00 0.00 O ATOM 1264 CB GLN A 83 -7.280 -11.910 -12.453 1.00 0.00 C ATOM 1265 CG GLN A 83 -7.935 -13.172 -11.889 1.00 0.00 C ATOM 1266 CD GLN A 83 -8.531 -14.029 -13.008 1.00 0.00 C ATOM 1267 OE1 GLN A 83 -9.714 -13.976 -13.302 1.00 0.00 O ATOM 1268 NE2 GLN A 83 -7.648 -14.818 -13.613 1.00 0.00 N ATOM 0 H GLN A 83 -8.823 -9.837 -11.504 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.497 -11.401 -10.538 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -7.925 -11.470 -13.214 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -6.342 -12.171 -12.942 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -7.197 -13.753 -11.336 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -8.717 -12.895 -11.183 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -6.672 -14.813 -13.317 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -7.947 -15.429 -14.374 1.00 0.00 H new ATOM 1277 N VAL A 84 -4.855 -9.828 -11.472 1.00 0.00 N ATOM 1278 CA VAL A 84 -3.892 -8.818 -11.877 1.00 0.00 C ATOM 1279 C VAL A 84 -2.831 -9.461 -12.773 1.00 0.00 C ATOM 1280 O VAL A 84 -2.141 -10.389 -12.355 1.00 0.00 O ATOM 1281 CB VAL A 84 -3.299 -8.136 -10.643 1.00 0.00 C ATOM 1282 CG1 VAL A 84 -4.011 -6.814 -10.351 1.00 0.00 C ATOM 1283 CG2 VAL A 84 -3.346 -9.064 -9.428 1.00 0.00 C ATOM 0 H VAL A 84 -4.473 -10.573 -10.889 1.00 0.00 H new ATOM 0 HA VAL A 84 -4.380 -8.037 -12.460 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.253 -7.913 -10.854 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.570 -6.350 -9.469 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.902 -6.146 -11.205 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.069 -7.003 -10.171 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.918 -8.555 -8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -4.381 -9.333 -9.215 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.772 -9.967 -9.637 1.00 0.00 H new ATOM 1293 N SER A 85 -2.736 -8.942 -13.988 1.00 0.00 N ATOM 1294 CA SER A 85 -1.771 -9.455 -14.947 1.00 0.00 C ATOM 1295 C SER A 85 -0.359 -9.375 -14.361 1.00 0.00 C ATOM 1296 O SER A 85 0.503 -10.185 -14.698 1.00 0.00 O ATOM 1297 CB SER A 85 -1.842 -8.683 -16.266 1.00 0.00 C ATOM 1298 OG SER A 85 -2.573 -9.395 -17.261 1.00 0.00 O ATOM 0 H SER A 85 -3.311 -8.172 -14.331 1.00 0.00 H new ATOM 0 HA SER A 85 -2.014 -10.497 -15.154 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.311 -7.714 -16.095 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.832 -8.488 -16.627 1.00 0.00 H new ATOM 0 HG SER A 85 -2.598 -8.869 -18.088 1.00 0.00 H new ATOM 1304 N SER A 86 -0.167 -8.391 -13.495 1.00 0.00 N ATOM 1305 CA SER A 86 1.125 -8.196 -12.860 1.00 0.00 C ATOM 1306 C SER A 86 0.933 -7.769 -11.403 1.00 0.00 C ATOM 1307 O SER A 86 0.521 -6.641 -11.132 1.00 0.00 O ATOM 1308 CB SER A 86 1.957 -7.155 -13.613 1.00 0.00 C ATOM 1309 OG SER A 86 1.745 -7.219 -15.020 1.00 0.00 O ATOM 0 H SER A 86 -0.884 -7.721 -13.218 1.00 0.00 H new ATOM 0 HA SER A 86 1.666 -9.142 -12.886 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.703 -6.158 -13.253 1.00 0.00 H new ATOM 0 HB3 SER A 86 3.014 -7.311 -13.398 1.00 0.00 H new ATOM 0 HG SER A 86 2.292 -6.538 -15.465 1.00 0.00 H new ATOM 1315 N GLN A 87 1.240 -8.692 -10.504 1.00 0.00 N ATOM 1316 CA GLN A 87 1.106 -8.425 -9.082 1.00 0.00 C ATOM 1317 C GLN A 87 1.448 -6.964 -8.781 1.00 0.00 C ATOM 1318 O GLN A 87 2.493 -6.469 -9.201 1.00 0.00 O ATOM 1319 CB GLN A 87 1.982 -9.374 -8.261 1.00 0.00 C ATOM 1320 CG GLN A 87 1.213 -9.929 -7.061 1.00 0.00 C ATOM 1321 CD GLN A 87 1.957 -11.109 -6.431 1.00 0.00 C ATOM 1322 OE1 GLN A 87 3.042 -10.974 -5.889 1.00 0.00 O ATOM 1323 NE2 GLN A 87 1.316 -12.270 -6.534 1.00 0.00 N ATOM 0 H GLN A 87 1.581 -9.626 -10.732 1.00 0.00 H new ATOM 0 HA GLN A 87 0.069 -8.601 -8.795 1.00 0.00 H new ATOM 0 HB2 GLN A 87 2.323 -10.196 -8.890 1.00 0.00 H new ATOM 0 HB3 GLN A 87 2.871 -8.847 -7.915 1.00 0.00 H new ATOM 0 HG2 GLN A 87 1.075 -9.143 -6.318 1.00 0.00 H new ATOM 0 HG3 GLN A 87 0.220 -10.248 -7.377 1.00 0.00 H new ATOM 0 HE21 GLN A 87 0.410 -12.313 -7.001 1.00 0.00 H new ATOM 0 HE22 GLN A 87 1.730 -13.118 -6.146 1.00 0.00 H new ATOM 1332 N PRO A 88 0.525 -6.299 -8.037 1.00 0.00 N ATOM 1333 CA PRO A 88 0.718 -4.905 -7.676 1.00 0.00 C ATOM 1334 C PRO A 88 1.762 -4.767 -6.566 1.00 0.00 C ATOM 1335 O PRO A 88 2.234 -5.765 -6.024 1.00 0.00 O ATOM 1336 CB PRO A 88 -0.658 -4.411 -7.261 1.00 0.00 C ATOM 1337 CG PRO A 88 -1.475 -5.657 -6.961 1.00 0.00 C ATOM 1338 CD PRO A 88 -0.724 -6.854 -7.523 1.00 0.00 C ATOM 0 HA PRO A 88 1.109 -4.307 -8.500 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.593 -3.766 -6.385 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -1.118 -3.824 -8.056 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -1.621 -5.768 -5.887 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.465 -5.582 -7.411 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -0.538 -7.602 -6.752 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -1.294 -7.344 -8.312 1.00 0.00 H new ATOM 1346 N GLU A 89 2.094 -3.520 -6.261 1.00 0.00 N ATOM 1347 CA GLU A 89 3.073 -3.238 -5.226 1.00 0.00 C ATOM 1348 C GLU A 89 2.395 -3.173 -3.856 1.00 0.00 C ATOM 1349 O GLU A 89 1.318 -2.595 -3.720 1.00 0.00 O ATOM 1350 CB GLU A 89 3.829 -1.942 -5.525 1.00 0.00 C ATOM 1351 CG GLU A 89 5.249 -2.236 -6.014 1.00 0.00 C ATOM 1352 CD GLU A 89 5.973 -3.187 -5.058 1.00 0.00 C ATOM 1353 OE1 GLU A 89 5.962 -2.888 -3.844 1.00 0.00 O ATOM 1354 OE2 GLU A 89 6.520 -4.191 -5.563 1.00 0.00 O ATOM 0 H GLU A 89 1.702 -2.694 -6.713 1.00 0.00 H new ATOM 0 HA GLU A 89 3.800 -4.050 -5.211 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.292 -1.369 -6.281 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.870 -1.325 -4.627 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.210 -2.676 -7.010 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.808 -1.304 -6.099 1.00 0.00 H new ATOM 1361 N LEU A 90 3.053 -3.775 -2.876 1.00 0.00 N ATOM 1362 CA LEU A 90 2.527 -3.792 -1.522 1.00 0.00 C ATOM 1363 C LEU A 90 3.367 -2.866 -0.641 1.00 0.00 C ATOM 1364 O LEU A 90 4.491 -3.204 -0.273 1.00 0.00 O ATOM 1365 CB LEU A 90 2.441 -5.228 -0.999 1.00 0.00 C ATOM 1366 CG LEU A 90 2.025 -6.290 -2.019 1.00 0.00 C ATOM 1367 CD1 LEU A 90 1.554 -7.567 -1.320 1.00 0.00 C ATOM 1368 CD2 LEU A 90 0.969 -5.741 -2.982 1.00 0.00 C ATOM 0 H LEU A 90 3.946 -4.255 -2.993 1.00 0.00 H new ATOM 0 HA LEU A 90 1.507 -3.409 -1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.414 -5.504 -0.593 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.732 -5.250 -0.171 1.00 0.00 H new ATOM 0 HG LEU A 90 2.899 -6.553 -2.615 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.264 -8.305 -2.068 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.363 -7.967 -0.709 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.698 -7.339 -0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.691 -6.515 -3.697 1.00 0.00 H new ATOM 0 HD22 LEU A 90 0.088 -5.433 -2.419 1.00 0.00 H new ATOM 0 HD23 LEU A 90 1.376 -4.883 -3.517 1.00 0.00 H new ATOM 1380 N LEU A 91 2.789 -1.716 -0.327 1.00 0.00 N ATOM 1381 CA LEU A 91 3.470 -0.738 0.504 1.00 0.00 C ATOM 1382 C LEU A 91 2.529 -0.278 1.620 1.00 0.00 C ATOM 1383 O LEU A 91 1.313 -0.423 1.509 1.00 0.00 O ATOM 1384 CB LEU A 91 4.015 0.407 -0.352 1.00 0.00 C ATOM 1385 CG LEU A 91 4.188 0.106 -1.842 1.00 0.00 C ATOM 1386 CD1 LEU A 91 3.977 1.367 -2.684 1.00 0.00 C ATOM 1387 CD2 LEU A 91 5.544 -0.546 -2.116 1.00 0.00 C ATOM 0 H LEU A 91 1.856 -1.440 -0.633 1.00 0.00 H new ATOM 0 HA LEU A 91 4.339 -1.187 0.985 1.00 0.00 H new ATOM 0 HB2 LEU A 91 3.346 1.261 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.981 0.708 0.052 1.00 0.00 H new ATOM 0 HG LEU A 91 3.421 -0.610 -2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.106 1.126 -3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.970 1.750 -2.519 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.705 2.124 -2.394 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.641 -0.749 -3.182 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.342 0.127 -1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.617 -1.481 -1.560 1.00 0.00 H new ATOM 1399 N ASP A 92 3.128 0.266 2.669 1.00 0.00 N ATOM 1400 CA ASP A 92 2.358 0.748 3.803 1.00 0.00 C ATOM 1401 C ASP A 92 1.685 2.071 3.432 1.00 0.00 C ATOM 1402 O ASP A 92 2.040 2.693 2.432 1.00 0.00 O ATOM 1403 CB ASP A 92 3.259 0.998 5.014 1.00 0.00 C ATOM 1404 CG ASP A 92 2.641 0.637 6.366 1.00 0.00 C ATOM 1405 OD1 ASP A 92 1.394 0.678 6.449 1.00 0.00 O ATOM 1406 OD2 ASP A 92 3.429 0.328 7.286 1.00 0.00 O ATOM 0 H ASP A 92 4.137 0.384 2.758 1.00 0.00 H new ATOM 0 HA ASP A 92 1.618 -0.011 4.055 1.00 0.00 H new ATOM 0 HB2 ASP A 92 4.179 0.426 4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 92 3.538 2.052 5.029 1.00 0.00 H new ATOM 1411 N VAL A 93 0.727 2.463 4.258 1.00 0.00 N ATOM 1412 CA VAL A 93 0.001 3.701 4.030 1.00 0.00 C ATOM 1413 C VAL A 93 0.988 4.870 4.015 1.00 0.00 C ATOM 1414 O VAL A 93 0.660 5.958 3.545 1.00 0.00 O ATOM 1415 CB VAL A 93 -1.101 3.863 5.078 1.00 0.00 C ATOM 1416 CG1 VAL A 93 -0.512 3.913 6.490 1.00 0.00 C ATOM 1417 CG2 VAL A 93 -1.950 5.104 4.794 1.00 0.00 C ATOM 0 H VAL A 93 0.436 1.945 5.087 1.00 0.00 H new ATOM 0 HA VAL A 93 -0.494 3.680 3.059 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.752 2.991 5.017 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -1.317 4.029 7.216 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.029 2.988 6.692 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.172 4.758 6.569 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.726 5.196 5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.316 5.991 4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.413 5.011 3.812 1.00 0.00 H new ATOM 1427 N SER A 94 2.178 4.605 4.535 1.00 0.00 N ATOM 1428 CA SER A 94 3.215 5.621 4.587 1.00 0.00 C ATOM 1429 C SER A 94 3.537 6.114 3.175 1.00 0.00 C ATOM 1430 O SER A 94 3.498 7.314 2.908 1.00 0.00 O ATOM 1431 CB SER A 94 4.478 5.085 5.263 1.00 0.00 C ATOM 1432 OG SER A 94 5.664 5.602 4.665 1.00 0.00 O ATOM 0 H SER A 94 2.447 3.701 4.924 1.00 0.00 H new ATOM 0 HA SER A 94 2.845 6.457 5.181 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.462 5.347 6.321 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.487 3.997 5.204 1.00 0.00 H new ATOM 0 HG SER A 94 6.448 5.237 5.126 1.00 0.00 H new ATOM 1438 N TRP A 95 3.848 5.162 2.307 1.00 0.00 N ATOM 1439 CA TRP A 95 4.176 5.483 0.929 1.00 0.00 C ATOM 1440 C TRP A 95 3.169 6.523 0.433 1.00 0.00 C ATOM 1441 O TRP A 95 3.556 7.577 -0.070 1.00 0.00 O ATOM 1442 CB TRP A 95 4.209 4.222 0.064 1.00 0.00 C ATOM 1443 CG TRP A 95 4.680 4.463 -1.372 1.00 0.00 C ATOM 1444 CD1 TRP A 95 5.908 4.797 -1.792 1.00 0.00 C ATOM 1445 CD2 TRP A 95 3.876 4.375 -2.567 1.00 0.00 C ATOM 1446 NE1 TRP A 95 5.954 4.930 -3.165 1.00 0.00 N ATOM 1447 CE2 TRP A 95 4.679 4.665 -3.651 1.00 0.00 C ATOM 1448 CE3 TRP A 95 2.515 4.060 -2.727 1.00 0.00 C ATOM 1449 CZ2 TRP A 95 4.213 4.669 -4.971 1.00 0.00 C ATOM 1450 CZ3 TRP A 95 2.064 4.068 -4.052 1.00 0.00 C ATOM 1451 CH2 TRP A 95 2.860 4.359 -5.154 1.00 0.00 C ATOM 0 H TRP A 95 3.880 4.168 2.532 1.00 0.00 H new ATOM 0 HA TRP A 95 5.177 5.908 0.860 1.00 0.00 H new ATOM 0 HB2 TRP A 95 4.866 3.490 0.533 1.00 0.00 H new ATOM 0 HB3 TRP A 95 3.211 3.785 0.039 1.00 0.00 H new ATOM 0 HD1 TRP A 95 6.755 4.944 -1.138 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.773 5.177 -3.721 1.00 0.00 H new ATOM 0 HE3 TRP A 95 1.868 3.830 -1.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.862 4.899 -5.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.025 3.832 -4.231 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.436 4.346 -6.147 1.00 0.00 H new ATOM 1462 N LEU A 96 1.897 6.189 0.591 1.00 0.00 N ATOM 1463 CA LEU A 96 0.831 7.081 0.166 1.00 0.00 C ATOM 1464 C LEU A 96 1.034 8.455 0.808 1.00 0.00 C ATOM 1465 O LEU A 96 1.215 9.450 0.108 1.00 0.00 O ATOM 1466 CB LEU A 96 -0.536 6.460 0.461 1.00 0.00 C ATOM 1467 CG LEU A 96 -1.702 6.971 -0.387 1.00 0.00 C ATOM 1468 CD1 LEU A 96 -1.292 7.113 -1.854 1.00 0.00 C ATOM 1469 CD2 LEU A 96 -2.934 6.080 -0.220 1.00 0.00 C ATOM 0 H LEU A 96 1.580 5.313 1.007 1.00 0.00 H new ATOM 0 HA LEU A 96 0.864 7.226 -0.914 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.460 5.381 0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.773 6.633 1.511 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.973 7.965 -0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.139 7.478 -2.435 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.466 7.820 -1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.978 6.143 -2.240 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -3.748 6.466 -0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.693 5.064 -0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.240 6.074 0.826 1.00 0.00 H new ATOM 1481 N ILE A 97 0.998 8.465 2.132 1.00 0.00 N ATOM 1482 CA ILE A 97 1.176 9.700 2.876 1.00 0.00 C ATOM 1483 C ILE A 97 2.267 10.540 2.208 1.00 0.00 C ATOM 1484 O ILE A 97 2.095 11.742 2.010 1.00 0.00 O ATOM 1485 CB ILE A 97 1.447 9.403 4.352 1.00 0.00 C ATOM 1486 CG1 ILE A 97 0.179 8.913 5.055 1.00 0.00 C ATOM 1487 CG2 ILE A 97 2.058 10.617 5.054 1.00 0.00 C ATOM 1488 CD1 ILE A 97 0.519 8.190 6.359 1.00 0.00 C ATOM 0 H ILE A 97 0.848 7.637 2.709 1.00 0.00 H new ATOM 0 HA ILE A 97 0.260 10.291 2.857 1.00 0.00 H new ATOM 0 HB ILE A 97 2.179 8.597 4.408 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -0.475 9.759 5.264 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -0.370 8.241 4.395 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.240 10.378 6.102 1.00 0.00 H new ATOM 0 HG22 ILE A 97 3.000 10.880 4.573 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.370 11.460 4.989 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.400 7.852 6.838 1.00 0.00 H new ATOM 0 HD12 ILE A 97 1.153 7.330 6.144 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.047 8.872 7.026 1.00 0.00 H new ATOM 1500 N GLU A 98 3.364 9.874 1.879 1.00 0.00 N ATOM 1501 CA GLU A 98 4.482 10.544 1.237 1.00 0.00 C ATOM 1502 C GLU A 98 4.134 10.888 -0.212 1.00 0.00 C ATOM 1503 O GLU A 98 4.405 11.995 -0.674 1.00 0.00 O ATOM 1504 CB GLU A 98 5.748 9.689 1.309 1.00 0.00 C ATOM 1505 CG GLU A 98 6.313 9.663 2.731 1.00 0.00 C ATOM 1506 CD GLU A 98 7.655 10.394 2.801 1.00 0.00 C ATOM 1507 OE1 GLU A 98 8.602 9.907 2.147 1.00 0.00 O ATOM 1508 OE2 GLU A 98 7.703 11.425 3.508 1.00 0.00 O ATOM 0 H GLU A 98 3.502 8.877 2.045 1.00 0.00 H new ATOM 0 HA GLU A 98 4.680 11.473 1.772 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.524 8.673 0.985 1.00 0.00 H new ATOM 0 HB3 GLU A 98 6.497 10.084 0.623 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.605 10.129 3.416 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.440 8.631 3.057 1.00 0.00 H new ATOM 1515 N CYS A 99 3.537 9.918 -0.890 1.00 0.00 N ATOM 1516 CA CYS A 99 3.149 10.104 -2.278 1.00 0.00 C ATOM 1517 C CYS A 99 2.258 11.344 -2.365 1.00 0.00 C ATOM 1518 O CYS A 99 2.253 12.039 -3.381 1.00 0.00 O ATOM 1519 CB CYS A 99 2.456 8.862 -2.843 1.00 0.00 C ATOM 1520 SG CYS A 99 3.620 7.450 -2.862 1.00 0.00 S ATOM 0 H CYS A 99 3.313 9.001 -0.504 1.00 0.00 H new ATOM 0 HA CYS A 99 4.038 10.253 -2.890 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.583 8.616 -2.239 1.00 0.00 H new ATOM 0 HB3 CYS A 99 2.098 9.063 -3.853 1.00 0.00 H new ATOM 0 HG CYS A 99 2.965 6.345 -2.666 1.00 0.00 H new ATOM 1526 N ILE A 100 1.526 11.585 -1.288 1.00 0.00 N ATOM 1527 CA ILE A 100 0.633 12.729 -1.230 1.00 0.00 C ATOM 1528 C ILE A 100 1.456 14.004 -1.032 1.00 0.00 C ATOM 1529 O ILE A 100 1.528 14.845 -1.927 1.00 0.00 O ATOM 1530 CB ILE A 100 -0.440 12.518 -0.160 1.00 0.00 C ATOM 1531 CG1 ILE A 100 -1.419 11.418 -0.574 1.00 0.00 C ATOM 1532 CG2 ILE A 100 -1.157 13.831 0.164 1.00 0.00 C ATOM 1533 CD1 ILE A 100 -2.293 10.988 0.606 1.00 0.00 C ATOM 0 H ILE A 100 1.533 11.007 -0.448 1.00 0.00 H new ATOM 0 HA ILE A 100 0.095 12.839 -2.171 1.00 0.00 H new ATOM 0 HB ILE A 100 0.051 12.185 0.754 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.050 11.776 -1.387 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -0.866 10.559 -0.954 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -1.915 13.653 0.927 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -0.434 14.559 0.533 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -1.633 14.217 -0.737 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.980 10.205 0.284 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -1.660 10.608 1.408 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -2.863 11.844 0.968 1.00 0.00 H new ATOM 1545 N GLY A 101 2.056 14.106 0.145 1.00 0.00 N ATOM 1546 CA GLY A 101 2.871 15.264 0.471 1.00 0.00 C ATOM 1547 C GLY A 101 3.984 15.459 -0.561 1.00 0.00 C ATOM 1548 O GLY A 101 4.582 16.531 -0.639 1.00 0.00 O ATOM 0 H GLY A 101 1.994 13.406 0.884 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.245 16.155 0.508 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.307 15.139 1.462 1.00 0.00 H new ATOM 1552 N ALA A 102 4.229 14.406 -1.327 1.00 0.00 N ATOM 1553 CA ALA A 102 5.259 14.448 -2.350 1.00 0.00 C ATOM 1554 C ALA A 102 4.614 14.743 -3.706 1.00 0.00 C ATOM 1555 O ALA A 102 5.291 15.168 -4.640 1.00 0.00 O ATOM 1556 CB ALA A 102 6.035 13.129 -2.348 1.00 0.00 C ATOM 0 H ALA A 102 3.731 13.518 -1.259 1.00 0.00 H new ATOM 0 HA ALA A 102 5.972 15.246 -2.144 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.808 13.160 -3.116 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.498 12.981 -1.373 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.352 12.305 -2.554 1.00 0.00 H new ATOM 1562 N GLY A 103 3.312 14.505 -3.770 1.00 0.00 N ATOM 1563 CA GLY A 103 2.568 14.740 -4.995 1.00 0.00 C ATOM 1564 C GLY A 103 3.133 13.907 -6.148 1.00 0.00 C ATOM 1565 O GLY A 103 2.886 14.207 -7.315 1.00 0.00 O ATOM 0 H GLY A 103 2.754 14.152 -2.993 1.00 0.00 H new ATOM 0 HA2 GLY A 103 1.518 14.490 -4.841 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.609 15.798 -5.252 1.00 0.00 H new ATOM 1569 N LYS A 104 3.880 12.876 -5.780 1.00 0.00 N ATOM 1570 CA LYS A 104 4.482 11.998 -6.769 1.00 0.00 C ATOM 1571 C LYS A 104 4.745 10.630 -6.136 1.00 0.00 C ATOM 1572 O LYS A 104 4.732 10.494 -4.914 1.00 0.00 O ATOM 1573 CB LYS A 104 5.729 12.646 -7.373 1.00 0.00 C ATOM 1574 CG LYS A 104 6.970 12.336 -6.533 1.00 0.00 C ATOM 1575 CD LYS A 104 7.805 11.227 -7.177 1.00 0.00 C ATOM 1576 CE LYS A 104 9.126 11.032 -6.430 1.00 0.00 C ATOM 1577 NZ LYS A 104 10.198 11.840 -7.052 1.00 0.00 N ATOM 0 H LYS A 104 4.082 12.629 -4.811 1.00 0.00 H new ATOM 0 HA LYS A 104 3.799 11.838 -7.603 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.875 12.284 -8.391 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.588 13.725 -7.436 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.575 13.236 -6.426 1.00 0.00 H new ATOM 0 HG3 LYS A 104 6.668 12.033 -5.530 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.241 10.294 -7.175 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.006 11.476 -8.219 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.006 11.319 -5.385 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.404 9.978 -6.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 11.087 11.696 -6.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.324 11.547 -8.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.938 12.846 -7.019 1.00 0.00 H new ATOM 1591 N PRO A 105 4.983 9.624 -7.020 1.00 0.00 N ATOM 1592 CA PRO A 105 5.249 8.271 -6.561 1.00 0.00 C ATOM 1593 C PRO A 105 6.664 8.153 -5.992 1.00 0.00 C ATOM 1594 O PRO A 105 7.588 7.750 -6.696 1.00 0.00 O ATOM 1595 CB PRO A 105 5.023 7.391 -7.780 1.00 0.00 C ATOM 1596 CG PRO A 105 5.094 8.317 -8.982 1.00 0.00 C ATOM 1597 CD PRO A 105 5.006 9.748 -8.475 1.00 0.00 C ATOM 0 HA PRO A 105 4.597 7.969 -5.742 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.781 6.610 -7.844 1.00 0.00 H new ATOM 0 HB3 PRO A 105 4.055 6.893 -7.728 1.00 0.00 H new ATOM 0 HG2 PRO A 105 6.024 8.162 -9.528 1.00 0.00 H new ATOM 0 HG3 PRO A 105 4.279 8.107 -9.674 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.858 10.340 -8.809 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.109 10.245 -8.845 1.00 0.00 H new ATOM 1605 N VAL A 106 6.789 8.513 -4.723 1.00 0.00 N ATOM 1606 CA VAL A 106 8.076 8.452 -4.051 1.00 0.00 C ATOM 1607 C VAL A 106 8.756 7.121 -4.379 1.00 0.00 C ATOM 1608 O VAL A 106 8.089 6.151 -4.734 1.00 0.00 O ATOM 1609 CB VAL A 106 7.893 8.676 -2.549 1.00 0.00 C ATOM 1610 CG1 VAL A 106 7.454 10.112 -2.258 1.00 0.00 C ATOM 1611 CG2 VAL A 106 6.902 7.670 -1.961 1.00 0.00 C ATOM 0 H VAL A 106 6.020 8.848 -4.142 1.00 0.00 H new ATOM 0 HA VAL A 106 8.731 9.247 -4.407 1.00 0.00 H new ATOM 0 HB VAL A 106 8.858 8.517 -2.067 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.331 10.244 -1.183 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.211 10.805 -2.625 1.00 0.00 H new ATOM 0 HG13 VAL A 106 6.507 10.311 -2.759 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.790 7.852 -0.892 1.00 0.00 H new ATOM 0 HG22 VAL A 106 5.935 7.783 -2.451 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.274 6.658 -2.120 1.00 0.00 H new ATOM 1621 N GLU A 107 10.074 7.119 -4.248 1.00 0.00 N ATOM 1622 CA GLU A 107 10.851 5.923 -4.526 1.00 0.00 C ATOM 1623 C GLU A 107 10.650 4.889 -3.417 1.00 0.00 C ATOM 1624 O GLU A 107 10.481 5.248 -2.252 1.00 0.00 O ATOM 1625 CB GLU A 107 12.334 6.260 -4.699 1.00 0.00 C ATOM 1626 CG GLU A 107 13.041 6.331 -3.344 1.00 0.00 C ATOM 1627 CD GLU A 107 14.135 7.401 -3.352 1.00 0.00 C ATOM 1628 OE1 GLU A 107 14.853 7.471 -4.372 1.00 0.00 O ATOM 1629 OE2 GLU A 107 14.228 8.125 -2.337 1.00 0.00 O ATOM 0 H GLU A 107 10.624 7.926 -3.953 1.00 0.00 H new ATOM 0 HA GLU A 107 10.498 5.494 -5.464 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.812 5.505 -5.324 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.436 7.214 -5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 107 12.315 6.554 -2.562 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.478 5.361 -3.106 1.00 0.00 H new ATOM 1636 N MET A 108 10.674 3.626 -3.817 1.00 0.00 N ATOM 1637 CA MET A 108 10.496 2.538 -2.871 1.00 0.00 C ATOM 1638 C MET A 108 11.833 1.871 -2.544 1.00 0.00 C ATOM 1639 O MET A 108 12.339 1.069 -3.328 1.00 0.00 O ATOM 1640 CB MET A 108 9.538 1.500 -3.460 1.00 0.00 C ATOM 1641 CG MET A 108 8.144 2.096 -3.668 1.00 0.00 C ATOM 1642 SD MET A 108 8.042 2.863 -5.277 1.00 0.00 S ATOM 1643 CE MET A 108 7.896 1.410 -6.304 1.00 0.00 C ATOM 0 H MET A 108 10.814 3.332 -4.784 1.00 0.00 H new ATOM 0 HA MET A 108 10.081 2.947 -1.950 1.00 0.00 H new ATOM 0 HB2 MET A 108 9.928 1.138 -4.411 1.00 0.00 H new ATOM 0 HB3 MET A 108 9.474 0.640 -2.794 1.00 0.00 H new ATOM 0 HG2 MET A 108 7.389 1.315 -3.580 1.00 0.00 H new ATOM 0 HG3 MET A 108 7.934 2.832 -2.891 1.00 0.00 H new ATOM 0 HE1 MET A 108 8.621 1.464 -7.116 1.00 0.00 H new ATOM 0 HE2 MET A 108 8.088 0.520 -5.705 1.00 0.00 H new ATOM 0 HE3 MET A 108 6.890 1.358 -6.719 1.00 0.00 H new ATOM 1653 N THR A 109 12.369 2.227 -1.386 1.00 0.00 N ATOM 1654 CA THR A 109 13.638 1.673 -0.946 1.00 0.00 C ATOM 1655 C THR A 109 13.410 0.394 -0.138 1.00 0.00 C ATOM 1656 O THR A 109 14.082 -0.612 -0.359 1.00 0.00 O ATOM 1657 CB THR A 109 14.384 2.759 -0.168 1.00 0.00 C ATOM 1658 OG1 THR A 109 13.733 2.787 1.099 1.00 0.00 O ATOM 1659 CG2 THR A 109 14.145 4.158 -0.740 1.00 0.00 C ATOM 0 H THR A 109 11.947 2.893 -0.739 1.00 0.00 H new ATOM 0 HA THR A 109 14.256 1.378 -1.794 1.00 0.00 H new ATOM 0 HB THR A 109 15.452 2.541 -0.175 1.00 0.00 H new ATOM 0 HG1 THR A 109 14.155 3.464 1.669 1.00 0.00 H new ATOM 0 HG21 THR A 109 14.697 4.891 -0.151 1.00 0.00 H new ATOM 0 HG22 THR A 109 14.487 4.191 -1.774 1.00 0.00 H new ATOM 0 HG23 THR A 109 13.081 4.390 -0.702 1.00 0.00 H new ATOM 1667 N GLY A 110 12.460 0.475 0.782 1.00 0.00 N ATOM 1668 CA GLY A 110 12.135 -0.664 1.624 1.00 0.00 C ATOM 1669 C GLY A 110 11.046 -0.303 2.637 1.00 0.00 C ATOM 1670 O GLY A 110 10.016 -0.970 2.710 1.00 0.00 O ATOM 0 H GLY A 110 11.905 1.311 0.963 1.00 0.00 H new ATOM 0 HA2 GLY A 110 11.799 -1.495 1.004 1.00 0.00 H new ATOM 0 HA3 GLY A 110 13.029 -0.999 2.150 1.00 0.00 H new ATOM 1674 N LYS A 111 11.313 0.751 3.394 1.00 0.00 N ATOM 1675 CA LYS A 111 10.368 1.208 4.399 1.00 0.00 C ATOM 1676 C LYS A 111 8.961 1.227 3.800 1.00 0.00 C ATOM 1677 O LYS A 111 8.026 0.684 4.386 1.00 0.00 O ATOM 1678 CB LYS A 111 10.809 2.556 4.975 1.00 0.00 C ATOM 1679 CG LYS A 111 12.218 2.465 5.567 1.00 0.00 C ATOM 1680 CD LYS A 111 13.227 3.217 4.697 1.00 0.00 C ATOM 1681 CE LYS A 111 13.135 4.726 4.933 1.00 0.00 C ATOM 1682 NZ LYS A 111 14.469 5.284 5.248 1.00 0.00 N ATOM 0 H LYS A 111 12.170 1.301 3.332 1.00 0.00 H new ATOM 0 HA LYS A 111 10.346 0.518 5.242 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.788 3.314 4.192 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.107 2.874 5.746 1.00 0.00 H new ATOM 0 HG2 LYS A 111 12.221 2.880 6.575 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.514 1.419 5.652 1.00 0.00 H new ATOM 0 HD2 LYS A 111 14.236 2.871 4.922 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.041 2.997 3.646 1.00 0.00 H new ATOM 0 HE2 LYS A 111 12.730 5.215 4.047 1.00 0.00 H new ATOM 0 HE3 LYS A 111 12.446 4.930 5.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.388 6.309 5.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.841 4.830 6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.116 5.106 4.454 1.00 0.00 H new ATOM 1696 N HIS A 112 8.854 1.858 2.640 1.00 0.00 N ATOM 1697 CA HIS A 112 7.577 1.955 1.955 1.00 0.00 C ATOM 1698 C HIS A 112 6.996 0.554 1.753 1.00 0.00 C ATOM 1699 O HIS A 112 5.824 0.317 2.041 1.00 0.00 O ATOM 1700 CB HIS A 112 7.720 2.732 0.645 1.00 0.00 C ATOM 1701 CG HIS A 112 8.414 4.065 0.794 1.00 0.00 C ATOM 1702 ND1 HIS A 112 8.995 4.731 -0.271 1.00 0.00 N ATOM 1703 CD2 HIS A 112 8.613 4.848 1.893 1.00 0.00 C ATOM 1704 CE1 HIS A 112 9.518 5.862 0.179 1.00 0.00 C ATOM 1705 NE2 HIS A 112 9.281 5.933 1.520 1.00 0.00 N ATOM 0 H HIS A 112 9.632 2.307 2.157 1.00 0.00 H new ATOM 0 HA HIS A 112 6.873 2.518 2.568 1.00 0.00 H new ATOM 0 HB2 HIS A 112 8.275 2.123 -0.068 1.00 0.00 H new ATOM 0 HB3 HIS A 112 6.729 2.895 0.221 1.00 0.00 H new ATOM 0 HD1 HIS A 112 9.017 4.406 -1.238 1.00 0.00 H new ATOM 0 HD2 HIS A 112 8.283 4.623 2.897 1.00 0.00 H new ATOM 0 HE1 HIS A 112 10.041 6.599 -0.413 1.00 0.00 H new ATOM 1713 N GLN A 113 7.842 -0.337 1.259 1.00 0.00 N ATOM 1714 CA GLN A 113 7.428 -1.708 1.015 1.00 0.00 C ATOM 1715 C GLN A 113 7.076 -2.399 2.334 1.00 0.00 C ATOM 1716 O GLN A 113 7.793 -2.259 3.323 1.00 0.00 O ATOM 1717 CB GLN A 113 8.511 -2.483 0.262 1.00 0.00 C ATOM 1718 CG GLN A 113 8.875 -1.784 -1.049 1.00 0.00 C ATOM 1719 CD GLN A 113 8.375 -2.584 -2.254 1.00 0.00 C ATOM 1720 OE1 GLN A 113 7.629 -3.542 -2.130 1.00 0.00 O ATOM 1721 NE2 GLN A 113 8.825 -2.139 -3.424 1.00 0.00 N ATOM 0 H GLN A 113 8.813 -0.136 1.021 1.00 0.00 H new ATOM 0 HA GLN A 113 6.537 -1.691 0.387 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.399 -2.575 0.888 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.161 -3.494 0.054 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.440 -0.785 -1.065 1.00 0.00 H new ATOM 0 HG3 GLN A 113 9.956 -1.662 -1.112 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.447 -1.331 -3.457 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.548 -2.605 -4.288 1.00 0.00 H new ATOM 1730 N LEU A 114 5.971 -3.131 2.305 1.00 0.00 N ATOM 1731 CA LEU A 114 5.516 -3.844 3.486 1.00 0.00 C ATOM 1732 C LEU A 114 6.413 -5.061 3.720 1.00 0.00 C ATOM 1733 O LEU A 114 7.027 -5.190 4.777 1.00 0.00 O ATOM 1734 CB LEU A 114 4.030 -4.189 3.364 1.00 0.00 C ATOM 1735 CG LEU A 114 3.099 -3.028 3.011 1.00 0.00 C ATOM 1736 CD1 LEU A 114 2.071 -3.449 1.959 1.00 0.00 C ATOM 1737 CD2 LEU A 114 2.434 -2.458 4.266 1.00 0.00 C ATOM 0 H LEU A 114 5.378 -3.245 1.483 1.00 0.00 H new ATOM 0 HA LEU A 114 5.601 -3.211 4.369 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.918 -4.962 2.604 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.699 -4.620 4.309 1.00 0.00 H new ATOM 0 HG LEU A 114 3.699 -2.230 2.573 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.422 -2.605 1.726 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.587 -3.770 1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.471 -4.272 2.346 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.777 -1.634 3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.850 -3.238 4.755 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.200 -2.096 4.951 1.00 0.00 H new ATOM 1749 N SER A 115 6.459 -5.924 2.715 1.00 0.00 N ATOM 1750 CA SER A 115 7.270 -7.126 2.797 1.00 0.00 C ATOM 1751 C SER A 115 7.254 -7.862 1.456 1.00 0.00 C ATOM 1752 O SER A 115 6.524 -7.479 0.543 1.00 0.00 O ATOM 1753 CB SER A 115 6.777 -8.048 3.914 1.00 0.00 C ATOM 1754 OG SER A 115 7.803 -8.337 4.860 1.00 0.00 O ATOM 0 H SER A 115 5.947 -5.814 1.840 1.00 0.00 H new ATOM 0 HA SER A 115 8.293 -6.832 3.030 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.935 -7.581 4.424 1.00 0.00 H new ATOM 0 HB3 SER A 115 6.411 -8.979 3.481 1.00 0.00 H new ATOM 0 HG SER A 115 7.448 -8.927 5.558 1.00 0.00 H new ATOM 1760 N GLY A 116 8.067 -8.905 1.379 1.00 0.00 N ATOM 1761 CA GLY A 116 8.154 -9.697 0.164 1.00 0.00 C ATOM 1762 C GLY A 116 8.952 -10.981 0.404 1.00 0.00 C ATOM 1763 O GLY A 116 9.045 -11.457 1.534 1.00 0.00 O ATOM 0 H GLY A 116 8.671 -9.220 2.138 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.152 -9.947 -0.184 1.00 0.00 H new ATOM 0 HA3 GLY A 116 8.628 -9.111 -0.623 1.00 0.00 H new ATOM 1767 N PRO A 117 9.521 -11.520 -0.708 1.00 0.00 N ATOM 1768 CA PRO A 117 10.308 -12.739 -0.630 1.00 0.00 C ATOM 1769 C PRO A 117 11.682 -12.467 -0.015 1.00 0.00 C ATOM 1770 O PRO A 117 12.535 -11.843 -0.645 1.00 0.00 O ATOM 1771 CB PRO A 117 10.387 -13.248 -2.060 1.00 0.00 C ATOM 1772 CG PRO A 117 10.043 -12.061 -2.945 1.00 0.00 C ATOM 1773 CD PRO A 117 9.432 -10.984 -2.063 1.00 0.00 C ATOM 0 HA PRO A 117 9.859 -13.489 0.021 1.00 0.00 H new ATOM 0 HB2 PRO A 117 11.384 -13.627 -2.285 1.00 0.00 H new ATOM 0 HB3 PRO A 117 9.690 -14.070 -2.221 1.00 0.00 H new ATOM 0 HG2 PRO A 117 10.936 -11.685 -3.443 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.343 -12.357 -3.726 1.00 0.00 H new ATOM 0 HD2 PRO A 117 9.975 -10.043 -2.153 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.398 -10.783 -2.342 1.00 0.00 H new ATOM 1781 N SER A 118 11.854 -12.947 1.207 1.00 0.00 N ATOM 1782 CA SER A 118 13.110 -12.764 1.914 1.00 0.00 C ATOM 1783 C SER A 118 13.846 -14.100 2.030 1.00 0.00 C ATOM 1784 O SER A 118 13.232 -15.161 1.931 1.00 0.00 O ATOM 1785 CB SER A 118 12.879 -12.163 3.302 1.00 0.00 C ATOM 1786 OG SER A 118 14.073 -11.614 3.852 1.00 0.00 O ATOM 0 H SER A 118 11.144 -13.463 1.726 1.00 0.00 H new ATOM 0 HA SER A 118 13.724 -12.067 1.344 1.00 0.00 H new ATOM 0 HB2 SER A 118 12.118 -11.385 3.238 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.492 -12.932 3.970 1.00 0.00 H new ATOM 0 HG SER A 118 13.883 -11.239 4.737 1.00 0.00 H new ATOM 1792 N SER A 119 15.151 -14.005 2.237 1.00 0.00 N ATOM 1793 CA SER A 119 15.977 -15.193 2.368 1.00 0.00 C ATOM 1794 C SER A 119 15.846 -15.769 3.779 1.00 0.00 C ATOM 1795 O SER A 119 15.453 -16.922 3.949 1.00 0.00 O ATOM 1796 CB SER A 119 17.442 -14.883 2.054 1.00 0.00 C ATOM 1797 OG SER A 119 17.935 -13.795 2.832 1.00 0.00 O ATOM 0 H SER A 119 15.657 -13.123 2.317 1.00 0.00 H new ATOM 0 HA SER A 119 15.628 -15.933 1.647 1.00 0.00 H new ATOM 0 HB2 SER A 119 18.049 -15.769 2.243 1.00 0.00 H new ATOM 0 HB3 SER A 119 17.544 -14.647 0.995 1.00 0.00 H new ATOM 0 HG SER A 119 18.874 -13.629 2.604 1.00 0.00 H new ATOM 1803 N GLY A 120 16.184 -14.940 4.756 1.00 0.00 N ATOM 1804 CA GLY A 120 16.109 -15.352 6.147 1.00 0.00 C ATOM 1805 C GLY A 120 17.279 -14.781 6.952 1.00 0.00 C ATOM 1806 O GLY A 120 17.781 -13.702 6.642 1.00 0.00 O ATOM 0 H GLY A 120 16.511 -13.985 4.611 1.00 0.00 H new ATOM 0 HA2 GLY A 120 15.167 -15.015 6.579 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.117 -16.440 6.209 1.00 0.00 H new TER 1810 GLY A 120