USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 998 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 47 THR OG1 : rot 180:sc= 0.235 USER MOD Set 1.2: A 71 GLN : amide:sc= 0.249 X(o=0.48,f=0.6) USER MOD Set 2.1: A 45 LYS NZ :NH3+ -143:sc= 1.23 (180deg=0) USER MOD Set 2.2: A 73 THR OG1 : rot 180:sc= 1.09 USER MOD Single : A 1 MET CE :methyl -161:sc= -0.125 (180deg=-0.654) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc=-0.00464 X(o=-0.0046,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 5 HIS : no HE2:sc= -0.377 K(o=-0.38,f=-1.3) USER MOD Single : A 6 HIS : no HD1:sc= -0.0274 X(o=-0.027,f=-0.074) USER MOD Single : A 7 HIS : no HD1:sc= -0.385 X(o=-0.38,f=-0.48) USER MOD Single : A 8 HIS : no HD1:sc= -0.197 X(o=-0.2,f=-0.082) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -32:sc= 0.191 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.68 K(o=-0.68,f=-3.7!) USER MOD Single : A 21 SER OG : rot 180:sc= 0.188 USER MOD Single : A 22 MET CE :methyl 157:sc= -0.176 (180deg=-0.803) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.974 K(o=-0.97,f=-0.045) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 42:sc= 1.11 USER MOD Single : A 39 LYS NZ :NH3+ -146:sc= -2.53! (180deg=-5.16!) USER MOD Single : A 41 GLN : amide:sc= -0.0235 X(o=-0.023,f=-0.35) USER MOD Single : A 44 LYS NZ :NH3+ 179:sc= 1.07 (180deg=1.01) USER MOD Single : A 49 HIS : no HD1:sc= -0.0894 K(o=0.42,f=-4.8!) USER MOD Single : A 50 TYR OH : rot 166:sc= -0.0489 USER MOD Single : A 58 LYS NZ :NH3+ -171:sc=-0.00172 (180deg=-0.121) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 SER OG : rot 91:sc= -0.0455 USER MOD Single : A 63 SER OG : rot 180:sc=-0.00603 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 170:sc=-0.000996 (180deg=-0.0645) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 89 THR OG1 : rot -40:sc= 0.492 USER MOD Single : A 90 MET CE :methyl -152:sc= -1.77 (180deg=-4.46!) USER MOD Single : A 91 THR OG1 : rot -140:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -120:sc= 0.928 (180deg=0.883) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 3:sc= 1.29 USER MOD Single : A 103 GLN : amide:sc= -1.67! X(o=-1.7!,f=-1.6) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.0119 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.307 -1.557 -13.907 1.00 3.40 N ATOM 2 CA MET A 1 12.898 -2.849 -13.313 1.00 10.21 C ATOM 3 C MET A 1 14.116 -3.747 -13.098 1.00 31.33 C ATOM 4 O MET A 1 14.498 -4.522 -13.985 1.00 3.30 O ATOM 5 CB MET A 1 11.874 -3.557 -14.215 1.00 73.31 C ATOM 6 CG MET A 1 11.360 -4.878 -13.657 1.00 65.15 C ATOM 7 SD MET A 1 10.229 -5.714 -14.793 1.00 4.42 S ATOM 8 CE MET A 1 8.947 -4.474 -14.979 1.00 65.21 C ATOM 0 H1 MET A 1 12.468 -0.958 -14.047 1.00 3.40 H new ATOM 0 H2 MET A 1 13.973 -1.077 -13.269 1.00 3.40 H new ATOM 0 H3 MET A 1 13.768 -1.727 -14.824 1.00 3.40 H new ATOM 0 HA MET A 1 12.434 -2.650 -12.347 1.00 10.21 H new ATOM 0 HB2 MET A 1 11.027 -2.890 -14.378 1.00 73.31 H new ATOM 0 HB3 MET A 1 12.329 -3.739 -15.189 1.00 73.31 H new ATOM 0 HG2 MET A 1 12.205 -5.532 -13.443 1.00 65.15 H new ATOM 0 HG3 MET A 1 10.851 -4.696 -12.711 1.00 65.15 H new ATOM 0 HE1 MET A 1 8.039 -4.943 -15.359 1.00 65.21 H new ATOM 0 HE2 MET A 1 8.741 -4.016 -14.012 1.00 65.21 H new ATOM 0 HE3 MET A 1 9.280 -3.708 -15.680 1.00 65.21 H new ATOM 20 N ALA A 2 14.742 -3.617 -11.933 1.00 11.55 N ATOM 21 CA ALA A 2 15.880 -4.452 -11.566 1.00 5.04 C ATOM 22 C ALA A 2 15.396 -5.846 -11.182 1.00 60.10 C ATOM 23 O ALA A 2 14.418 -5.992 -10.446 1.00 53.10 O ATOM 24 CB ALA A 2 16.662 -3.817 -10.420 1.00 52.24 C ATOM 0 H ALA A 2 14.478 -2.935 -11.222 1.00 11.55 H new ATOM 0 HA ALA A 2 16.548 -4.537 -12.423 1.00 5.04 H new ATOM 0 HB1 ALA A 2 17.507 -4.454 -10.160 1.00 52.24 H new ATOM 0 HB2 ALA A 2 17.027 -2.837 -10.728 1.00 52.24 H new ATOM 0 HB3 ALA A 2 16.011 -3.706 -9.553 1.00 52.24 H new ATOM 30 N HIS A 3 16.073 -6.872 -11.685 1.00 21.32 N ATOM 31 CA HIS A 3 15.665 -8.250 -11.435 1.00 71.41 C ATOM 32 C HIS A 3 16.047 -8.687 -10.022 1.00 74.23 C ATOM 33 O HIS A 3 17.026 -9.409 -9.821 1.00 21.43 O ATOM 34 CB HIS A 3 16.268 -9.200 -12.483 1.00 10.53 C ATOM 35 CG HIS A 3 15.795 -8.925 -13.880 1.00 12.00 C ATOM 36 ND1 HIS A 3 16.520 -9.253 -15.002 1.00 64.50 N ATOM 37 CD2 HIS A 3 14.649 -8.357 -14.332 1.00 70.35 C ATOM 38 CE1 HIS A 3 15.845 -8.900 -16.080 1.00 44.42 C ATOM 39 NE2 HIS A 3 14.705 -8.353 -15.701 1.00 50.14 N ATOM 0 H HIS A 3 16.905 -6.776 -12.267 1.00 21.32 H new ATOM 0 HA HIS A 3 14.579 -8.298 -11.520 1.00 71.41 H new ATOM 0 HB2 HIS A 3 17.355 -9.119 -12.453 1.00 10.53 H new ATOM 0 HB3 HIS A 3 16.017 -10.227 -12.218 1.00 10.53 H new ATOM 0 HD2 HIS A 3 13.841 -7.978 -13.724 1.00 70.35 H new ATOM 0 HE1 HIS A 3 16.171 -9.036 -17.101 1.00 44.42 H new ATOM 0 HE2 HIS A 3 13.985 -7.988 -16.324 1.00 50.14 H new ATOM 48 N HIS A 4 15.291 -8.200 -9.040 1.00 41.44 N ATOM 49 CA HIS A 4 15.474 -8.589 -7.641 1.00 61.42 C ATOM 50 C HIS A 4 14.140 -9.010 -7.025 1.00 34.24 C ATOM 51 O HIS A 4 14.102 -9.574 -5.927 1.00 73.23 O ATOM 52 CB HIS A 4 16.087 -7.438 -6.829 1.00 70.34 C ATOM 53 CG HIS A 4 17.470 -7.056 -7.272 1.00 12.14 C ATOM 54 ND1 HIS A 4 17.846 -5.758 -7.547 1.00 24.54 N ATOM 55 CD2 HIS A 4 18.572 -7.814 -7.477 1.00 32.52 C ATOM 56 CE1 HIS A 4 19.117 -5.737 -7.907 1.00 45.00 C ATOM 57 NE2 HIS A 4 19.580 -6.970 -7.870 1.00 44.43 N ATOM 0 H HIS A 4 14.538 -7.528 -9.189 1.00 41.44 H new ATOM 0 HA HIS A 4 16.160 -9.436 -7.613 1.00 61.42 H new ATOM 0 HB2 HIS A 4 15.437 -6.566 -6.904 1.00 70.34 H new ATOM 0 HB3 HIS A 4 16.118 -7.723 -5.777 1.00 70.34 H new ATOM 0 HD2 HIS A 4 18.645 -8.885 -7.354 1.00 32.52 H new ATOM 0 HE1 HIS A 4 19.681 -4.859 -8.184 1.00 45.00 H new ATOM 0 HE2 HIS A 4 20.534 -7.252 -8.097 1.00 44.43 H new ATOM 66 N HIS A 5 13.051 -8.726 -7.740 1.00 33.34 N ATOM 67 CA HIS A 5 11.700 -9.078 -7.304 1.00 30.04 C ATOM 68 C HIS A 5 10.761 -9.126 -8.504 1.00 71.42 C ATOM 69 O HIS A 5 10.702 -8.179 -9.290 1.00 43.00 O ATOM 70 CB HIS A 5 11.175 -8.075 -6.259 1.00 43.53 C ATOM 71 CG HIS A 5 11.240 -8.578 -4.845 1.00 2.34 C ATOM 72 ND1 HIS A 5 12.375 -8.504 -4.069 1.00 73.32 N ATOM 73 CD2 HIS A 5 10.298 -9.171 -4.070 1.00 13.00 C ATOM 74 CE1 HIS A 5 12.133 -9.033 -2.884 1.00 45.42 C ATOM 75 NE2 HIS A 5 10.881 -9.444 -2.858 1.00 75.32 N ATOM 0 H HIS A 5 13.081 -8.245 -8.639 1.00 33.34 H new ATOM 0 HA HIS A 5 11.738 -10.063 -6.838 1.00 30.04 H new ATOM 0 HB2 HIS A 5 11.752 -7.153 -6.333 1.00 43.53 H new ATOM 0 HB3 HIS A 5 10.141 -7.824 -6.498 1.00 43.53 H new ATOM 0 HD1 HIS A 5 13.265 -8.103 -4.364 1.00 73.32 H new ATOM 0 HD2 HIS A 5 9.279 -9.388 -4.354 1.00 13.00 H new ATOM 0 HE1 HIS A 5 12.841 -9.115 -2.073 1.00 45.42 H new ATOM 84 N HIS A 6 10.054 -10.239 -8.650 1.00 63.13 N ATOM 85 CA HIS A 6 9.086 -10.410 -9.726 1.00 11.21 C ATOM 86 C HIS A 6 8.168 -11.587 -9.423 1.00 65.13 C ATOM 87 O HIS A 6 8.624 -12.635 -8.965 1.00 22.35 O ATOM 88 CB HIS A 6 9.793 -10.639 -11.069 1.00 13.32 C ATOM 89 CG HIS A 6 8.847 -10.925 -12.202 1.00 73.33 C ATOM 90 ND1 HIS A 6 8.546 -12.204 -12.623 1.00 11.11 N ATOM 91 CD2 HIS A 6 8.120 -10.093 -12.991 1.00 2.41 C ATOM 92 CE1 HIS A 6 7.682 -12.144 -13.618 1.00 15.55 C ATOM 93 NE2 HIS A 6 7.407 -10.878 -13.859 1.00 40.03 N ATOM 0 H HIS A 6 10.134 -11.045 -8.030 1.00 63.13 H new ATOM 0 HA HIS A 6 8.494 -9.498 -9.797 1.00 11.21 H new ATOM 0 HB2 HIS A 6 10.385 -9.757 -11.314 1.00 13.32 H new ATOM 0 HB3 HIS A 6 10.488 -11.472 -10.967 1.00 13.32 H new ATOM 0 HD2 HIS A 6 8.106 -9.014 -12.943 1.00 2.41 H new ATOM 0 HE1 HIS A 6 7.269 -12.991 -14.147 1.00 15.55 H new ATOM 0 HE2 HIS A 6 6.767 -10.537 -14.576 1.00 40.03 H new ATOM 102 N HIS A 7 6.879 -11.403 -9.679 1.00 35.24 N ATOM 103 CA HIS A 7 5.890 -12.459 -9.501 1.00 21.22 C ATOM 104 C HIS A 7 4.828 -12.355 -10.592 1.00 62.14 C ATOM 105 O HIS A 7 4.078 -11.381 -10.653 1.00 65.32 O ATOM 106 CB HIS A 7 5.244 -12.384 -8.105 1.00 40.00 C ATOM 107 CG HIS A 7 4.448 -11.136 -7.860 1.00 5.42 C ATOM 108 ND1 HIS A 7 3.069 -11.106 -7.875 1.00 32.01 N ATOM 109 CD2 HIS A 7 4.845 -9.870 -7.596 1.00 63.42 C ATOM 110 CE1 HIS A 7 2.656 -9.876 -7.634 1.00 15.31 C ATOM 111 NE2 HIS A 7 3.714 -9.110 -7.462 1.00 2.11 N ATOM 0 H HIS A 7 6.491 -10.522 -10.014 1.00 35.24 H new ATOM 0 HA HIS A 7 6.391 -13.424 -9.581 1.00 21.22 H new ATOM 0 HB2 HIS A 7 4.593 -13.248 -7.972 1.00 40.00 H new ATOM 0 HB3 HIS A 7 6.027 -12.455 -7.351 1.00 40.00 H new ATOM 0 HD2 HIS A 7 5.864 -9.523 -7.507 1.00 63.42 H new ATOM 0 HE1 HIS A 7 1.627 -9.553 -7.586 1.00 15.31 H new ATOM 0 HE2 HIS A 7 3.694 -8.110 -7.261 1.00 2.11 H new ATOM 120 N HIS A 8 4.794 -13.348 -11.468 1.00 54.52 N ATOM 121 CA HIS A 8 3.844 -13.367 -12.572 1.00 71.42 C ATOM 122 C HIS A 8 2.508 -13.935 -12.114 1.00 60.23 C ATOM 123 O HIS A 8 2.457 -15.004 -11.509 1.00 64.12 O ATOM 124 CB HIS A 8 4.388 -14.205 -13.739 1.00 2.44 C ATOM 125 CG HIS A 8 3.420 -14.345 -14.881 1.00 43.31 C ATOM 126 ND1 HIS A 8 2.572 -15.424 -15.028 1.00 41.21 N ATOM 127 CD2 HIS A 8 3.171 -13.532 -15.934 1.00 73.24 C ATOM 128 CE1 HIS A 8 1.849 -15.266 -16.120 1.00 22.34 C ATOM 129 NE2 HIS A 8 2.189 -14.126 -16.691 1.00 54.34 N ATOM 0 H HIS A 8 5.416 -14.155 -11.436 1.00 54.52 H new ATOM 0 HA HIS A 8 3.698 -12.341 -12.911 1.00 71.42 H new ATOM 0 HB2 HIS A 8 5.307 -13.748 -14.106 1.00 2.44 H new ATOM 0 HB3 HIS A 8 4.650 -15.197 -13.372 1.00 2.44 H new ATOM 0 HD2 HIS A 8 3.655 -12.589 -16.142 1.00 73.24 H new ATOM 0 HE1 HIS A 8 1.103 -15.955 -16.486 1.00 22.34 H new ATOM 0 HE2 HIS A 8 1.790 -13.749 -17.550 1.00 54.34 H new ATOM 138 N MET A 9 1.437 -13.205 -12.390 1.00 34.13 N ATOM 139 CA MET A 9 0.088 -13.692 -12.136 1.00 52.34 C ATOM 140 C MET A 9 -0.689 -13.750 -13.449 1.00 10.22 C ATOM 141 O MET A 9 -0.626 -12.820 -14.259 1.00 4.13 O ATOM 142 CB MET A 9 -0.645 -12.798 -11.127 1.00 35.21 C ATOM 143 CG MET A 9 -2.035 -13.321 -10.774 1.00 10.04 C ATOM 144 SD MET A 9 -2.919 -12.277 -9.596 1.00 4.34 S ATOM 145 CE MET A 9 -4.424 -13.229 -9.385 1.00 21.11 C ATOM 0 H MET A 9 1.476 -12.268 -12.792 1.00 34.13 H new ATOM 0 HA MET A 9 0.157 -14.692 -11.707 1.00 52.34 H new ATOM 0 HB2 MET A 9 -0.049 -12.720 -10.218 1.00 35.21 H new ATOM 0 HB3 MET A 9 -0.734 -11.792 -11.537 1.00 35.21 H new ATOM 0 HG2 MET A 9 -2.625 -13.406 -11.686 1.00 10.04 H new ATOM 0 HG3 MET A 9 -1.942 -14.325 -10.360 1.00 10.04 H new ATOM 0 HE1 MET A 9 -5.082 -12.718 -8.683 1.00 21.11 H new ATOM 0 HE2 MET A 9 -4.928 -13.331 -10.346 1.00 21.11 H new ATOM 0 HE3 MET A 9 -4.178 -14.218 -8.998 1.00 21.11 H new ATOM 155 N GLY A 10 -1.394 -14.854 -13.660 1.00 72.52 N ATOM 156 CA GLY A 10 -2.183 -15.035 -14.864 1.00 63.23 C ATOM 157 C GLY A 10 -2.643 -16.470 -15.019 1.00 1.24 C ATOM 158 O GLY A 10 -1.824 -17.392 -15.016 1.00 31.32 O ATOM 0 H GLY A 10 -1.433 -15.638 -13.009 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -3.050 -14.376 -14.834 1.00 63.23 H new ATOM 0 HA3 GLY A 10 -1.593 -14.746 -15.733 1.00 63.23 H new ATOM 162 N THR A 11 -3.951 -16.661 -15.146 1.00 0.32 N ATOM 163 CA THR A 11 -4.526 -17.992 -15.283 1.00 22.11 C ATOM 164 C THR A 11 -4.211 -18.582 -16.658 1.00 23.13 C ATOM 165 O THR A 11 -4.356 -19.785 -16.870 1.00 3.55 O ATOM 166 CB THR A 11 -6.060 -17.975 -15.060 1.00 61.11 C ATOM 167 OG1 THR A 11 -6.576 -19.314 -15.063 1.00 12.15 O ATOM 168 CG2 THR A 11 -6.770 -17.154 -16.133 1.00 23.11 C ATOM 0 H THR A 11 -4.636 -15.905 -15.157 1.00 0.32 H new ATOM 0 HA THR A 11 -4.074 -18.619 -14.514 1.00 22.11 H new ATOM 0 HB THR A 11 -6.248 -17.512 -14.091 1.00 61.11 H new ATOM 0 HG1 THR A 11 -6.042 -19.869 -15.669 1.00 12.15 H new ATOM 0 HG21 THR A 11 -7.844 -17.163 -15.947 1.00 23.11 H new ATOM 0 HG22 THR A 11 -6.406 -16.127 -16.106 1.00 23.11 H new ATOM 0 HG23 THR A 11 -6.568 -17.585 -17.114 1.00 23.11 H new ATOM 176 N LEU A 12 -3.809 -17.714 -17.595 1.00 23.05 N ATOM 177 CA LEU A 12 -3.392 -18.124 -18.943 1.00 13.01 C ATOM 178 C LEU A 12 -4.554 -18.704 -19.762 1.00 72.23 C ATOM 179 O LEU A 12 -4.361 -19.120 -20.910 1.00 0.21 O ATOM 180 CB LEU A 12 -2.234 -19.135 -18.866 1.00 64.41 C ATOM 181 CG LEU A 12 -0.994 -18.663 -18.084 1.00 51.22 C ATOM 182 CD1 LEU A 12 0.115 -19.711 -18.135 1.00 51.14 C ATOM 183 CD2 LEU A 12 -0.493 -17.317 -18.610 1.00 60.24 C ATOM 0 H LEU A 12 -3.763 -16.707 -17.440 1.00 23.05 H new ATOM 0 HA LEU A 12 -3.050 -17.227 -19.458 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -2.605 -20.051 -18.407 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -1.928 -19.388 -19.881 1.00 64.41 H new ATOM 0 HG LEU A 12 -1.287 -18.530 -17.043 1.00 51.22 H new ATOM 0 HD11 LEU A 12 0.979 -19.354 -17.575 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -0.243 -20.641 -17.694 1.00 51.14 H new ATOM 0 HD13 LEU A 12 0.402 -19.887 -19.172 1.00 51.14 H new ATOM 0 HD21 LEU A 12 0.383 -17.007 -18.040 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -0.226 -17.414 -19.662 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -1.279 -16.569 -18.503 1.00 60.24 H new ATOM 195 N GLU A 13 -5.753 -18.727 -19.180 1.00 22.00 N ATOM 196 CA GLU A 13 -6.945 -19.204 -19.876 1.00 22.14 C ATOM 197 C GLU A 13 -7.731 -18.021 -20.437 1.00 41.33 C ATOM 198 O GLU A 13 -8.093 -17.099 -19.697 1.00 42.24 O ATOM 199 CB GLU A 13 -7.841 -20.023 -18.936 1.00 43.13 C ATOM 200 CG GLU A 13 -7.161 -21.245 -18.325 1.00 63.33 C ATOM 201 CD GLU A 13 -8.135 -22.129 -17.561 1.00 30.35 C ATOM 202 OE1 GLU A 13 -8.386 -21.864 -16.366 1.00 14.15 O ATOM 203 OE2 GLU A 13 -8.665 -23.091 -18.159 1.00 43.21 O ATOM 0 H GLU A 13 -5.923 -18.419 -18.223 1.00 22.00 H new ATOM 0 HA GLU A 13 -6.625 -19.848 -20.695 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -8.190 -19.376 -18.131 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -8.723 -20.350 -19.487 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -6.689 -21.828 -19.116 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -6.368 -20.918 -17.653 1.00 63.33 H new ATOM 210 N ALA A 14 -7.980 -18.042 -21.743 1.00 14.03 N ATOM 211 CA ALA A 14 -8.738 -16.984 -22.404 1.00 33.23 C ATOM 212 C ALA A 14 -10.225 -17.332 -22.450 1.00 11.25 C ATOM 213 O ALA A 14 -10.659 -18.143 -23.270 1.00 22.03 O ATOM 214 CB ALA A 14 -8.198 -16.737 -23.810 1.00 1.45 C ATOM 0 H ALA A 14 -7.666 -18.785 -22.368 1.00 14.03 H new ATOM 0 HA ALA A 14 -8.622 -16.067 -21.826 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -8.775 -15.945 -24.288 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -7.152 -16.438 -23.751 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -8.281 -17.651 -24.398 1.00 1.45 H new ATOM 220 N GLN A 15 -10.993 -16.732 -21.544 1.00 71.12 N ATOM 221 CA GLN A 15 -12.442 -16.911 -21.513 1.00 54.40 C ATOM 222 C GLN A 15 -13.072 -16.194 -22.706 1.00 43.42 C ATOM 223 O GLN A 15 -14.105 -16.613 -23.232 1.00 31.11 O ATOM 224 CB GLN A 15 -13.008 -16.365 -20.192 1.00 11.24 C ATOM 225 CG GLN A 15 -14.508 -16.577 -20.007 1.00 43.33 C ATOM 226 CD GLN A 15 -15.018 -16.012 -18.691 1.00 41.31 C ATOM 227 OE1 GLN A 15 -14.481 -15.033 -18.168 1.00 20.25 O ATOM 228 NE2 GLN A 15 -16.057 -16.624 -18.144 1.00 24.31 N ATOM 0 H GLN A 15 -10.633 -16.114 -20.817 1.00 71.12 H new ATOM 0 HA GLN A 15 -12.679 -17.973 -21.577 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -12.483 -16.839 -19.363 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -12.796 -15.297 -20.135 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -15.043 -16.106 -20.832 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -14.729 -17.643 -20.051 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -16.475 -17.431 -18.606 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -16.440 -16.288 -17.260 1.00 24.31 H new ATOM 237 N THR A 16 -12.419 -15.113 -23.123 1.00 0.12 N ATOM 238 CA THR A 16 -12.837 -14.339 -24.282 1.00 75.23 C ATOM 239 C THR A 16 -11.643 -14.138 -25.216 1.00 40.03 C ATOM 240 O THR A 16 -10.642 -13.528 -24.829 1.00 21.31 O ATOM 241 CB THR A 16 -13.396 -12.959 -23.858 1.00 75.20 C ATOM 242 OG1 THR A 16 -14.387 -13.129 -22.835 1.00 44.10 O ATOM 243 CG2 THR A 16 -14.010 -12.222 -25.047 1.00 2.15 C ATOM 0 H THR A 16 -11.583 -14.750 -22.664 1.00 0.12 H new ATOM 0 HA THR A 16 -13.627 -14.887 -24.795 1.00 75.23 H new ATOM 0 HB THR A 16 -12.568 -12.362 -23.475 1.00 75.20 H new ATOM 0 HG1 THR A 16 -14.736 -12.253 -22.569 1.00 44.10 H new ATOM 0 HG21 THR A 16 -14.394 -11.256 -24.718 1.00 2.15 H new ATOM 0 HG22 THR A 16 -13.249 -12.068 -25.812 1.00 2.15 H new ATOM 0 HG23 THR A 16 -14.826 -12.815 -25.461 1.00 2.15 H new ATOM 251 N GLN A 17 -11.741 -14.669 -26.430 1.00 23.22 N ATOM 252 CA GLN A 17 -10.656 -14.587 -27.406 1.00 3.02 C ATOM 253 C GLN A 17 -10.574 -13.189 -28.010 1.00 51.13 C ATOM 254 O GLN A 17 -9.483 -12.625 -28.146 1.00 53.23 O ATOM 255 CB GLN A 17 -10.840 -15.641 -28.514 1.00 70.42 C ATOM 256 CG GLN A 17 -10.514 -17.070 -28.076 1.00 72.33 C ATOM 257 CD GLN A 17 -11.367 -17.565 -26.918 1.00 71.23 C ATOM 258 OE1 GLN A 17 -12.534 -17.196 -26.780 1.00 71.31 O ATOM 259 NE2 GLN A 17 -10.778 -18.391 -26.067 1.00 44.13 N ATOM 0 H GLN A 17 -12.567 -15.165 -26.765 1.00 23.22 H new ATOM 0 HA GLN A 17 -9.719 -14.791 -26.887 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -11.871 -15.606 -28.866 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -10.205 -15.378 -29.360 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -10.647 -17.740 -28.926 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -9.464 -17.122 -27.790 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -9.809 -18.673 -26.217 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -11.293 -18.746 -25.261 1.00 44.13 H new ATOM 268 N GLY A 18 -11.727 -12.625 -28.354 1.00 10.21 N ATOM 269 CA GLY A 18 -11.753 -11.304 -28.954 1.00 61.13 C ATOM 270 C GLY A 18 -13.160 -10.756 -29.127 1.00 70.32 C ATOM 271 O GLY A 18 -13.955 -10.783 -28.187 1.00 74.25 O ATOM 0 H GLY A 18 -12.642 -13.058 -28.228 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -11.176 -10.618 -28.334 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -11.263 -11.343 -29.927 1.00 61.13 H new ATOM 275 N PRO A 19 -13.500 -10.261 -30.333 1.00 71.50 N ATOM 276 CA PRO A 19 -14.778 -9.581 -30.585 1.00 35.41 C ATOM 277 C PRO A 19 -15.972 -10.535 -30.601 1.00 54.13 C ATOM 278 O PRO A 19 -15.926 -11.606 -31.216 1.00 73.40 O ATOM 279 CB PRO A 19 -14.573 -8.951 -31.970 1.00 23.33 C ATOM 280 CG PRO A 19 -13.583 -9.840 -32.641 1.00 14.54 C ATOM 281 CD PRO A 19 -12.664 -10.331 -31.551 1.00 31.43 C ATOM 0 HA PRO A 19 -15.013 -8.863 -29.799 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -15.508 -8.906 -32.528 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -14.200 -7.930 -31.890 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -14.080 -10.673 -33.138 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -13.027 -9.298 -33.406 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -12.321 -11.347 -31.744 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -11.775 -9.706 -31.464 1.00 31.43 H new ATOM 289 N GLY A 20 -17.035 -10.131 -29.915 1.00 31.23 N ATOM 290 CA GLY A 20 -18.285 -10.868 -29.927 1.00 1.24 C ATOM 291 C GLY A 20 -19.465 -9.926 -29.806 1.00 25.15 C ATOM 292 O GLY A 20 -20.437 -10.215 -29.113 1.00 53.44 O ATOM 0 H GLY A 20 -17.051 -9.289 -29.340 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -18.365 -11.442 -30.850 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -18.299 -11.583 -29.105 1.00 1.24 H new ATOM 296 N SER A 21 -19.369 -8.786 -30.484 1.00 21.21 N ATOM 297 CA SER A 21 -20.381 -7.736 -30.397 1.00 53.15 C ATOM 298 C SER A 21 -21.309 -7.766 -31.613 1.00 14.20 C ATOM 299 O SER A 21 -21.018 -8.426 -32.614 1.00 73.52 O ATOM 300 CB SER A 21 -19.694 -6.367 -30.289 1.00 54.50 C ATOM 301 OG SER A 21 -20.641 -5.320 -30.148 1.00 2.55 O ATOM 0 H SER A 21 -18.592 -8.564 -31.106 1.00 21.21 H new ATOM 0 HA SER A 21 -20.986 -7.910 -29.507 1.00 53.15 H new ATOM 0 HB2 SER A 21 -19.017 -6.365 -29.434 1.00 54.50 H new ATOM 0 HB3 SER A 21 -19.086 -6.192 -31.177 1.00 54.50 H new ATOM 0 HG SER A 21 -20.172 -4.462 -30.080 1.00 2.55 H new ATOM 307 N MET A 22 -22.427 -7.050 -31.510 1.00 23.10 N ATOM 308 CA MET A 22 -23.385 -6.917 -32.609 1.00 1.00 C ATOM 309 C MET A 22 -23.416 -5.462 -33.091 1.00 72.15 C ATOM 310 O MET A 22 -24.195 -5.093 -33.973 1.00 54.32 O ATOM 311 CB MET A 22 -24.782 -7.363 -32.143 1.00 40.45 C ATOM 312 CG MET A 22 -25.814 -7.473 -33.262 1.00 23.11 C ATOM 313 SD MET A 22 -27.470 -7.845 -32.644 1.00 11.22 S ATOM 314 CE MET A 22 -27.806 -6.375 -31.674 1.00 2.32 C ATOM 0 H MET A 22 -22.695 -6.546 -30.665 1.00 23.10 H new ATOM 0 HA MET A 22 -23.078 -7.555 -33.438 1.00 1.00 H new ATOM 0 HB2 MET A 22 -24.695 -8.331 -31.649 1.00 40.45 H new ATOM 0 HB3 MET A 22 -25.146 -6.656 -31.398 1.00 40.45 H new ATOM 0 HG2 MET A 22 -25.840 -6.537 -33.821 1.00 23.11 H new ATOM 0 HG3 MET A 22 -25.507 -8.252 -33.960 1.00 23.11 H new ATOM 0 HE1 MET A 22 -28.883 -6.247 -31.569 1.00 2.32 H new ATOM 0 HE2 MET A 22 -27.355 -6.479 -30.687 1.00 2.32 H new ATOM 0 HE3 MET A 22 -27.384 -5.504 -32.176 1.00 2.32 H new ATOM 324 N SER A 23 -22.557 -4.640 -32.495 1.00 10.14 N ATOM 325 CA SER A 23 -22.468 -3.223 -32.832 1.00 32.11 C ATOM 326 C SER A 23 -21.295 -2.970 -33.785 1.00 62.52 C ATOM 327 O SER A 23 -20.577 -3.900 -34.158 1.00 32.10 O ATOM 328 CB SER A 23 -22.303 -2.404 -31.544 1.00 71.33 C ATOM 329 OG SER A 23 -23.324 -2.722 -30.609 1.00 5.30 O ATOM 0 H SER A 23 -21.906 -4.936 -31.768 1.00 10.14 H new ATOM 0 HA SER A 23 -23.384 -2.916 -33.337 1.00 32.11 H new ATOM 0 HB2 SER A 23 -21.326 -2.603 -31.104 1.00 71.33 H new ATOM 0 HB3 SER A 23 -22.336 -1.340 -31.778 1.00 71.33 H new ATOM 0 HG SER A 23 -23.199 -2.191 -29.795 1.00 5.30 H new ATOM 335 N ALA A 24 -21.108 -1.713 -34.183 1.00 60.44 N ATOM 336 CA ALA A 24 -19.999 -1.341 -35.056 1.00 54.02 C ATOM 337 C ALA A 24 -18.787 -0.947 -34.222 1.00 62.11 C ATOM 338 O ALA A 24 -18.867 -0.036 -33.395 1.00 62.02 O ATOM 339 CB ALA A 24 -20.402 -0.199 -35.984 1.00 34.21 C ATOM 0 H ALA A 24 -21.711 -0.935 -33.914 1.00 60.44 H new ATOM 0 HA ALA A 24 -19.738 -2.202 -35.671 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -19.561 0.062 -36.626 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -21.245 -0.511 -36.600 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -20.688 0.669 -35.390 1.00 34.21 H new ATOM 345 N GLN A 25 -17.673 -1.632 -34.447 1.00 52.11 N ATOM 346 CA GLN A 25 -16.447 -1.397 -33.691 1.00 33.31 C ATOM 347 C GLN A 25 -15.567 -0.374 -34.404 1.00 11.54 C ATOM 348 O GLN A 25 -15.397 -0.434 -35.625 1.00 33.33 O ATOM 349 CB GLN A 25 -15.676 -2.718 -33.517 1.00 24.32 C ATOM 350 CG GLN A 25 -16.417 -3.766 -32.689 1.00 62.34 C ATOM 351 CD GLN A 25 -16.514 -3.405 -31.213 1.00 50.24 C ATOM 352 OE1 GLN A 25 -17.490 -3.745 -30.539 1.00 54.31 O ATOM 353 NE2 GLN A 25 -15.489 -2.750 -30.686 1.00 0.52 N ATOM 0 H GLN A 25 -17.593 -2.362 -35.154 1.00 52.11 H new ATOM 0 HA GLN A 25 -16.714 -1.005 -32.710 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -15.461 -3.133 -34.501 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -14.717 -2.507 -33.043 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -17.422 -3.894 -33.092 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -15.909 -4.725 -32.789 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -14.698 -2.484 -31.272 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -15.491 -2.512 -29.694 1.00 0.52 H new ATOM 362 N LEU A 26 -15.025 0.573 -33.643 1.00 30.13 N ATOM 363 CA LEU A 26 -14.076 1.544 -34.173 1.00 12.14 C ATOM 364 C LEU A 26 -12.680 1.194 -33.676 1.00 51.43 C ATOM 365 O LEU A 26 -12.329 1.464 -32.522 1.00 61.15 O ATOM 366 CB LEU A 26 -14.460 2.971 -33.741 1.00 71.53 C ATOM 367 CG LEU A 26 -13.517 4.086 -34.233 1.00 4.02 C ATOM 368 CD1 LEU A 26 -13.497 4.154 -35.761 1.00 1.33 C ATOM 369 CD2 LEU A 26 -13.917 5.434 -33.629 1.00 14.44 C ATOM 0 H LEU A 26 -15.230 0.688 -32.650 1.00 30.13 H new ATOM 0 HA LEU A 26 -14.094 1.509 -35.262 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.466 3.184 -34.102 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.498 3.005 -32.652 1.00 71.53 H new ATOM 0 HG LEU A 26 -12.507 3.849 -33.898 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -12.824 4.949 -36.081 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -13.151 3.202 -36.163 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -14.502 4.360 -36.129 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -13.240 6.209 -33.988 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -14.937 5.678 -33.926 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -13.860 5.377 -32.542 1.00 14.44 H new ATOM 381 N GLU A 27 -11.893 0.578 -34.550 1.00 2.20 N ATOM 382 CA GLU A 27 -10.564 0.096 -34.196 1.00 14.02 C ATOM 383 C GLU A 27 -9.629 0.183 -35.399 1.00 65.33 C ATOM 384 O GLU A 27 -9.747 -0.602 -36.347 1.00 60.33 O ATOM 385 CB GLU A 27 -10.643 -1.358 -33.691 1.00 53.11 C ATOM 386 CG GLU A 27 -11.428 -1.515 -32.391 1.00 1.14 C ATOM 387 CD GLU A 27 -11.599 -2.960 -31.959 1.00 4.22 C ATOM 388 OE1 GLU A 27 -10.583 -3.682 -31.864 1.00 43.34 O ATOM 389 OE2 GLU A 27 -12.746 -3.372 -31.679 1.00 35.30 O ATOM 0 H GLU A 27 -12.156 0.399 -35.519 1.00 2.20 H new ATOM 0 HA GLU A 27 -10.167 0.725 -33.399 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -11.105 -1.976 -34.461 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -9.632 -1.737 -33.542 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -10.919 -0.965 -31.600 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -12.412 -1.061 -32.512 1.00 1.14 H new ATOM 396 N LYS A 28 -8.718 1.154 -35.371 1.00 20.23 N ATOM 397 CA LYS A 28 -7.702 1.285 -36.410 1.00 1.42 C ATOM 398 C LYS A 28 -6.347 1.595 -35.781 1.00 24.22 C ATOM 399 O LYS A 28 -6.264 2.285 -34.761 1.00 43.22 O ATOM 400 CB LYS A 28 -8.083 2.353 -37.465 1.00 13.42 C ATOM 401 CG LYS A 28 -7.599 3.777 -37.175 1.00 53.12 C ATOM 402 CD LYS A 28 -8.364 4.446 -36.037 1.00 50.34 C ATOM 403 CE LYS A 28 -7.829 5.849 -35.764 1.00 71.00 C ATOM 404 NZ LYS A 28 -8.598 6.547 -34.701 1.00 31.34 N ATOM 0 H LYS A 28 -8.664 1.862 -34.638 1.00 20.23 H new ATOM 0 HA LYS A 28 -7.638 0.332 -36.936 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -7.682 2.043 -38.430 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.169 2.371 -37.561 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -6.538 3.751 -36.926 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -7.700 4.380 -38.077 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -9.423 4.500 -36.289 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -8.282 3.840 -35.134 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -6.781 5.785 -35.470 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -7.867 6.435 -36.682 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -8.199 7.495 -34.550 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -9.593 6.632 -34.991 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -8.541 6.002 -33.817 1.00 31.34 H new ATOM 418 N LYS A 29 -5.293 1.063 -36.383 1.00 10.31 N ATOM 419 CA LYS A 29 -3.932 1.243 -35.895 1.00 4.51 C ATOM 420 C LYS A 29 -2.990 1.444 -37.075 1.00 32.22 C ATOM 421 O LYS A 29 -2.808 0.538 -37.890 1.00 50.14 O ATOM 422 CB LYS A 29 -3.506 0.018 -35.072 1.00 34.44 C ATOM 423 CG LYS A 29 -2.080 0.092 -34.531 1.00 63.44 C ATOM 424 CD LYS A 29 -1.734 -1.133 -33.682 1.00 73.32 C ATOM 425 CE LYS A 29 -1.782 -2.429 -34.491 1.00 34.34 C ATOM 426 NZ LYS A 29 -1.512 -3.626 -33.649 1.00 5.41 N ATOM 0 H LYS A 29 -5.357 0.493 -37.226 1.00 10.31 H new ATOM 0 HA LYS A 29 -3.889 2.124 -35.254 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -4.194 -0.101 -34.235 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -3.602 -0.873 -35.692 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -1.379 0.169 -35.362 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -1.964 0.995 -33.932 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -0.738 -1.009 -33.257 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -2.431 -1.202 -32.847 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -2.762 -2.528 -34.957 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -1.049 -2.380 -35.296 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -1.555 -4.482 -34.238 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -0.566 -3.545 -33.224 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -2.226 -3.689 -32.896 1.00 5.41 H new ATOM 440 N VAL A 30 -2.424 2.639 -37.187 1.00 1.11 N ATOM 441 CA VAL A 30 -1.499 2.949 -38.273 1.00 62.04 C ATOM 442 C VAL A 30 -0.201 2.148 -38.123 1.00 61.23 C ATOM 443 O VAL A 30 0.407 2.127 -37.051 1.00 52.32 O ATOM 444 CB VAL A 30 -1.183 4.470 -38.344 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.566 4.974 -37.040 1.00 33.10 C ATOM 446 CG2 VAL A 30 -0.275 4.783 -39.535 1.00 70.43 C ATOM 0 H VAL A 30 -2.588 3.410 -36.540 1.00 1.11 H new ATOM 0 HA VAL A 30 -1.987 2.664 -39.205 1.00 62.04 H new ATOM 0 HB VAL A 30 -2.126 4.997 -38.487 1.00 12.12 H new ATOM 0 HG11 VAL A 30 -0.358 6.041 -37.124 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -1.262 4.804 -36.219 1.00 33.10 H new ATOM 0 HG13 VAL A 30 0.363 4.437 -36.846 1.00 33.10 H new ATOM 0 HG21 VAL A 30 -0.068 5.853 -39.564 1.00 70.43 H new ATOM 0 HG22 VAL A 30 0.662 4.235 -39.432 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.771 4.485 -40.459 1.00 70.43 H new ATOM 456 N LEU A 31 0.199 1.464 -39.193 1.00 3.31 N ATOM 457 CA LEU A 31 1.442 0.696 -39.194 1.00 51.44 C ATOM 458 C LEU A 31 2.581 1.562 -39.711 1.00 63.53 C ATOM 459 O LEU A 31 3.685 1.555 -39.169 1.00 71.22 O ATOM 460 CB LEU A 31 1.334 -0.563 -40.078 1.00 73.13 C ATOM 461 CG LEU A 31 0.299 -1.622 -39.653 1.00 33.10 C ATOM 462 CD1 LEU A 31 0.444 -1.975 -38.175 1.00 41.32 C ATOM 463 CD2 LEU A 31 -1.118 -1.162 -39.976 1.00 61.33 C ATOM 0 H LEU A 31 -0.320 1.426 -40.070 1.00 3.31 H new ATOM 0 HA LEU A 31 1.636 0.383 -38.168 1.00 51.44 H new ATOM 0 HB2 LEU A 31 1.098 -0.246 -41.094 1.00 73.13 H new ATOM 0 HB3 LEU A 31 2.314 -1.040 -40.112 1.00 73.13 H new ATOM 0 HG LEU A 31 0.493 -2.528 -40.227 1.00 33.10 H new ATOM 0 HD11 LEU A 31 -0.300 -2.725 -37.905 1.00 41.32 H new ATOM 0 HD12 LEU A 31 1.442 -2.372 -37.992 1.00 41.32 H new ATOM 0 HD13 LEU A 31 0.293 -1.080 -37.571 1.00 41.32 H new ATOM 0 HD21 LEU A 31 -1.829 -1.928 -39.666 1.00 61.33 H new ATOM 0 HD22 LEU A 31 -1.329 -0.234 -39.444 1.00 61.33 H new ATOM 0 HD23 LEU A 31 -1.210 -0.994 -41.049 1.00 61.33 H new ATOM 475 N THR A 32 2.300 2.309 -40.769 1.00 73.42 N ATOM 476 CA THR A 32 3.315 3.105 -41.434 1.00 63.14 C ATOM 477 C THR A 32 2.744 4.459 -41.857 1.00 74.03 C ATOM 478 O THR A 32 1.881 4.523 -42.731 1.00 24.43 O ATOM 479 CB THR A 32 3.847 2.353 -42.676 1.00 71.24 C ATOM 480 OG1 THR A 32 4.269 1.031 -42.300 1.00 42.12 O ATOM 481 CG2 THR A 32 5.008 3.100 -43.322 1.00 61.24 C ATOM 0 H THR A 32 1.371 2.379 -41.185 1.00 73.42 H new ATOM 0 HA THR A 32 4.134 3.273 -40.735 1.00 63.14 H new ATOM 0 HB THR A 32 3.039 2.288 -43.404 1.00 71.24 H new ATOM 0 HG1 THR A 32 4.604 0.557 -43.090 1.00 42.12 H new ATOM 0 HG21 THR A 32 5.359 2.545 -44.192 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.675 4.090 -43.633 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.821 3.200 -42.603 1.00 61.24 H new ATOM 489 N PRO A 33 3.191 5.557 -41.212 1.00 53.10 N ATOM 490 CA PRO A 33 2.776 6.914 -41.582 1.00 31.44 C ATOM 491 C PRO A 33 3.316 7.316 -42.958 1.00 3.51 C ATOM 492 O PRO A 33 4.478 7.038 -43.286 1.00 22.31 O ATOM 493 CB PRO A 33 3.376 7.805 -40.474 1.00 1.05 C ATOM 494 CG PRO A 33 3.762 6.863 -39.379 1.00 71.12 C ATOM 495 CD PRO A 33 4.108 5.568 -40.059 1.00 42.35 C ATOM 0 HA PRO A 33 1.692 7.005 -41.658 1.00 31.44 H new ATOM 0 HB2 PRO A 33 4.240 8.359 -40.839 1.00 1.05 H new ATOM 0 HB3 PRO A 33 2.651 8.540 -40.124 1.00 1.05 H new ATOM 0 HG2 PRO A 33 4.611 7.247 -38.813 1.00 71.12 H new ATOM 0 HG3 PRO A 33 2.943 6.728 -38.672 1.00 71.12 H new ATOM 0 HD2 PRO A 33 5.152 5.540 -40.371 1.00 42.35 H new ATOM 0 HD3 PRO A 33 3.948 4.711 -39.405 1.00 42.35 H new ATOM 503 N GLY A 34 2.475 7.964 -43.755 1.00 1.22 N ATOM 504 CA GLY A 34 2.872 8.372 -45.091 1.00 71.12 C ATOM 505 C GLY A 34 3.505 9.749 -45.111 1.00 51.22 C ATOM 506 O GLY A 34 4.234 10.121 -44.186 1.00 33.52 O ATOM 0 H GLY A 34 1.520 8.216 -43.499 1.00 1.22 H new ATOM 0 HA2 GLY A 34 3.577 7.645 -45.495 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.999 8.367 -45.744 1.00 71.12 H new ATOM 510 N ASP A 35 3.233 10.505 -46.170 1.00 1.32 N ATOM 511 CA ASP A 35 3.750 11.865 -46.307 1.00 65.45 C ATOM 512 C ASP A 35 3.117 12.783 -45.273 1.00 14.34 C ATOM 513 O ASP A 35 3.771 13.686 -44.748 1.00 32.43 O ATOM 514 CB ASP A 35 3.488 12.404 -47.719 1.00 64.24 C ATOM 515 CG ASP A 35 4.327 11.697 -48.768 1.00 72.41 C ATOM 516 OD1 ASP A 35 4.017 10.536 -49.102 1.00 51.11 O ATOM 517 OD2 ASP A 35 5.315 12.291 -49.247 1.00 4.21 O ATOM 0 H ASP A 35 2.654 10.197 -46.951 1.00 1.32 H new ATOM 0 HA ASP A 35 4.827 11.837 -46.139 1.00 65.45 H new ATOM 0 HB2 ASP A 35 2.432 12.286 -47.961 1.00 64.24 H new ATOM 0 HB3 ASP A 35 3.703 13.472 -47.744 1.00 64.24 H new ATOM 522 N GLY A 36 1.831 12.557 -45.010 1.00 33.03 N ATOM 523 CA GLY A 36 1.106 13.319 -43.995 1.00 42.44 C ATOM 524 C GLY A 36 0.733 14.728 -44.436 1.00 51.13 C ATOM 525 O GLY A 36 -0.293 15.266 -44.013 1.00 23.41 O ATOM 0 H GLY A 36 1.269 11.851 -45.486 1.00 33.03 H new ATOM 0 HA2 GLY A 36 0.197 12.779 -43.728 1.00 42.44 H new ATOM 0 HA3 GLY A 36 1.717 13.380 -43.094 1.00 42.44 H new ATOM 529 N VAL A 37 1.554 15.320 -45.297 1.00 62.44 N ATOM 530 CA VAL A 37 1.314 16.669 -45.803 1.00 70.24 C ATOM 531 C VAL A 37 0.277 16.657 -46.924 1.00 51.32 C ATOM 532 O VAL A 37 -0.192 17.708 -47.368 1.00 73.24 O ATOM 533 CB VAL A 37 2.624 17.309 -46.327 1.00 11.24 C ATOM 534 CG1 VAL A 37 3.661 17.404 -45.211 1.00 11.54 C ATOM 535 CG2 VAL A 37 3.175 16.523 -47.520 1.00 52.31 C ATOM 0 H VAL A 37 2.400 14.883 -45.663 1.00 62.44 H new ATOM 0 HA VAL A 37 0.935 17.263 -44.971 1.00 70.24 H new ATOM 0 HB VAL A 37 2.397 18.320 -46.666 1.00 11.24 H new ATOM 0 HG11 VAL A 37 4.573 17.856 -45.600 1.00 11.54 H new ATOM 0 HG12 VAL A 37 3.268 18.018 -44.401 1.00 11.54 H new ATOM 0 HG13 VAL A 37 3.883 16.405 -44.834 1.00 11.54 H new ATOM 0 HG21 VAL A 37 4.095 16.991 -47.871 1.00 52.31 H new ATOM 0 HG22 VAL A 37 3.383 15.497 -47.215 1.00 52.31 H new ATOM 0 HG23 VAL A 37 2.440 16.520 -48.325 1.00 52.31 H new ATOM 545 N THR A 38 -0.066 15.460 -47.381 1.00 10.01 N ATOM 546 CA THR A 38 -1.014 15.280 -48.469 1.00 12.05 C ATOM 547 C THR A 38 -2.448 15.228 -47.937 1.00 25.34 C ATOM 548 O THR A 38 -2.795 14.320 -47.175 1.00 54.22 O ATOM 549 CB THR A 38 -0.702 13.974 -49.229 1.00 44.23 C ATOM 550 OG1 THR A 38 -0.711 12.873 -48.304 1.00 15.11 O ATOM 551 CG2 THR A 38 0.658 14.050 -49.922 1.00 33.03 C ATOM 0 H THR A 38 0.306 14.587 -47.007 1.00 10.01 H new ATOM 0 HA THR A 38 -0.921 16.129 -49.146 1.00 12.05 H new ATOM 0 HB THR A 38 -1.465 13.828 -49.993 1.00 44.23 H new ATOM 0 HG1 THR A 38 -1.462 12.974 -47.683 1.00 15.11 H new ATOM 0 HG21 THR A 38 0.850 13.116 -50.449 1.00 33.03 H new ATOM 0 HG22 THR A 38 0.658 14.875 -50.634 1.00 33.03 H new ATOM 0 HG23 THR A 38 1.437 14.214 -49.177 1.00 33.03 H new ATOM 559 N LYS A 39 -3.266 16.205 -48.317 1.00 43.31 N ATOM 560 CA LYS A 39 -4.676 16.212 -47.938 1.00 13.11 C ATOM 561 C LYS A 39 -5.520 15.534 -49.019 1.00 41.21 C ATOM 562 O LYS A 39 -5.604 16.024 -50.151 1.00 63.14 O ATOM 563 CB LYS A 39 -5.176 17.642 -47.696 1.00 22.03 C ATOM 564 CG LYS A 39 -4.545 18.323 -46.484 1.00 14.54 C ATOM 565 CD LYS A 39 -5.206 19.665 -46.153 1.00 41.50 C ATOM 566 CE LYS A 39 -6.629 19.510 -45.604 1.00 4.21 C ATOM 567 NZ LYS A 39 -7.609 19.063 -46.635 1.00 32.51 N ATOM 0 H LYS A 39 -2.978 17.001 -48.886 1.00 43.31 H new ATOM 0 HA LYS A 39 -4.777 15.654 -47.007 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -4.974 18.242 -48.583 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -6.258 17.621 -47.566 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.620 17.662 -45.620 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -3.483 18.482 -46.673 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -4.595 20.194 -45.421 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -5.234 20.282 -47.051 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -6.619 18.791 -44.785 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -6.957 20.463 -45.188 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -8.535 19.497 -46.445 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -7.278 19.353 -47.577 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -7.699 18.027 -46.603 1.00 32.51 H new ATOM 581 N PRO A 40 -6.142 14.386 -48.696 1.00 42.33 N ATOM 582 CA PRO A 40 -6.990 13.654 -49.636 1.00 34.02 C ATOM 583 C PRO A 40 -8.290 14.401 -49.944 1.00 15.53 C ATOM 584 O PRO A 40 -9.168 14.524 -49.083 1.00 20.24 O ATOM 585 CB PRO A 40 -7.280 12.318 -48.919 1.00 14.44 C ATOM 586 CG PRO A 40 -6.317 12.267 -47.778 1.00 71.04 C ATOM 587 CD PRO A 40 -6.060 13.696 -47.398 1.00 13.23 C ATOM 0 HA PRO A 40 -6.502 13.523 -50.602 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -8.311 12.276 -48.566 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -7.139 11.472 -49.591 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -6.733 11.708 -46.940 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -5.393 11.767 -48.068 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -6.802 14.069 -46.692 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -5.083 13.823 -46.931 1.00 13.23 H new ATOM 595 N GLN A 41 -8.382 14.936 -51.157 1.00 71.30 N ATOM 596 CA GLN A 41 -9.612 15.558 -51.637 1.00 74.23 C ATOM 597 C GLN A 41 -10.445 14.529 -52.403 1.00 54.51 C ATOM 598 O GLN A 41 -9.978 13.942 -53.386 1.00 73.51 O ATOM 599 CB GLN A 41 -9.302 16.783 -52.521 1.00 32.32 C ATOM 600 CG GLN A 41 -8.234 16.539 -53.583 1.00 20.14 C ATOM 601 CD GLN A 41 -8.124 17.677 -54.586 1.00 75.11 C ATOM 602 OE1 GLN A 41 -8.765 17.657 -55.639 1.00 42.13 O ATOM 603 NE2 GLN A 41 -7.331 18.686 -54.263 1.00 32.25 N ATOM 0 H GLN A 41 -7.615 14.951 -51.829 1.00 71.30 H new ATOM 0 HA GLN A 41 -10.186 15.908 -50.779 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -10.221 17.102 -53.013 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -8.980 17.605 -51.882 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -7.270 16.397 -53.095 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -8.462 15.615 -54.114 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -6.816 18.668 -53.383 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -7.235 19.482 -54.894 1.00 32.25 H new ATOM 612 N ALA A 42 -11.665 14.299 -51.930 1.00 32.14 N ATOM 613 CA ALA A 42 -12.559 13.316 -52.534 1.00 64.43 C ATOM 614 C ALA A 42 -13.014 13.768 -53.920 1.00 53.00 C ATOM 615 O ALA A 42 -13.043 14.965 -54.217 1.00 74.42 O ATOM 616 CB ALA A 42 -13.759 13.067 -51.624 1.00 22.33 C ATOM 0 H ALA A 42 -12.060 14.784 -51.124 1.00 32.14 H new ATOM 0 HA ALA A 42 -12.012 12.381 -52.653 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -14.419 12.332 -52.085 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -13.414 12.691 -50.661 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -14.303 14.000 -51.475 1.00 22.33 H new ATOM 622 N GLY A 43 -13.361 12.803 -54.763 1.00 22.23 N ATOM 623 CA GLY A 43 -13.801 13.098 -56.115 1.00 40.21 C ATOM 624 C GLY A 43 -12.822 12.592 -57.154 1.00 65.14 C ATOM 625 O GLY A 43 -13.210 12.275 -58.282 1.00 43.04 O ATOM 0 H GLY A 43 -13.345 11.810 -54.531 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.777 12.644 -56.286 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -13.926 14.175 -56.229 1.00 40.21 H new ATOM 629 N LYS A 44 -11.549 12.512 -56.777 1.00 15.02 N ATOM 630 CA LYS A 44 -10.502 12.069 -57.696 1.00 4.12 C ATOM 631 C LYS A 44 -10.379 10.548 -57.703 1.00 2.42 C ATOM 632 O LYS A 44 -10.811 9.867 -56.766 1.00 21.32 O ATOM 633 CB LYS A 44 -9.142 12.676 -57.320 1.00 74.43 C ATOM 634 CG LYS A 44 -9.130 14.198 -57.227 1.00 13.21 C ATOM 635 CD LYS A 44 -7.703 14.747 -57.188 1.00 25.44 C ATOM 636 CE LYS A 44 -6.863 14.107 -56.084 1.00 74.31 C ATOM 637 NZ LYS A 44 -5.442 14.543 -56.141 1.00 24.40 N ATOM 0 H LYS A 44 -11.216 12.748 -55.842 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.788 12.411 -58.691 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -8.828 12.264 -56.361 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.403 12.364 -58.058 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -9.660 14.620 -58.081 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -9.667 14.513 -56.332 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -7.224 14.575 -58.152 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -7.736 15.826 -57.037 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -7.283 14.367 -55.112 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -6.913 13.022 -56.173 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -4.911 14.099 -55.365 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -5.028 14.258 -57.051 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -5.392 15.578 -56.047 1.00 24.40 H new ATOM 651 N LYS A 45 -9.792 10.027 -58.775 1.00 31.54 N ATOM 652 CA LYS A 45 -9.462 8.612 -58.868 1.00 2.24 C ATOM 653 C LYS A 45 -8.197 8.339 -58.055 1.00 43.32 C ATOM 654 O LYS A 45 -7.112 8.806 -58.412 1.00 1.42 O ATOM 655 CB LYS A 45 -9.243 8.217 -60.338 1.00 23.45 C ATOM 656 CG LYS A 45 -9.161 6.709 -60.574 1.00 51.53 C ATOM 657 CD LYS A 45 -10.520 6.031 -60.400 1.00 61.23 C ATOM 658 CE LYS A 45 -11.531 6.516 -61.436 1.00 43.20 C ATOM 659 NZ LYS A 45 -12.873 5.909 -61.236 1.00 55.24 N ATOM 0 H LYS A 45 -9.533 10.571 -59.598 1.00 31.54 H new ATOM 0 HA LYS A 45 -10.285 8.018 -58.470 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -10.057 8.624 -60.937 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -8.323 8.680 -60.694 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -8.786 6.519 -61.580 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -8.445 6.271 -59.879 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -10.401 4.951 -60.486 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -10.901 6.231 -59.399 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -11.613 7.602 -61.381 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -11.170 6.274 -62.435 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -13.309 5.719 -62.161 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -12.776 5.018 -60.709 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -13.474 6.565 -60.698 1.00 55.24 H new ATOM 673 N VAL A 46 -8.335 7.597 -56.962 1.00 62.24 N ATOM 674 CA VAL A 46 -7.217 7.338 -56.060 1.00 12.10 C ATOM 675 C VAL A 46 -6.712 5.904 -56.197 1.00 64.05 C ATOM 676 O VAL A 46 -7.465 4.994 -56.573 1.00 45.11 O ATOM 677 CB VAL A 46 -7.600 7.610 -54.583 1.00 33.35 C ATOM 678 CG1 VAL A 46 -8.039 9.062 -54.406 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.687 6.642 -54.107 1.00 33.14 C ATOM 0 H VAL A 46 -9.213 7.163 -56.678 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.420 8.024 -56.347 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.718 7.442 -53.965 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -8.305 9.237 -53.364 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -7.222 9.726 -54.689 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.904 9.260 -55.039 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.935 6.856 -53.068 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.577 6.762 -54.725 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.323 5.618 -54.189 1.00 33.14 H new ATOM 689 N THR A 47 -5.428 5.727 -55.895 1.00 20.33 N ATOM 690 CA THR A 47 -4.766 4.435 -55.976 1.00 43.45 C ATOM 691 C THR A 47 -4.522 3.882 -54.569 1.00 3.34 C ATOM 692 O THR A 47 -3.705 4.418 -53.801 1.00 53.32 O ATOM 693 CB THR A 47 -3.424 4.556 -56.736 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.642 5.235 -57.986 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.811 3.182 -56.996 1.00 54.21 C ATOM 0 H THR A 47 -4.817 6.483 -55.586 1.00 20.33 H new ATOM 0 HA THR A 47 -5.413 3.749 -56.523 1.00 43.45 H new ATOM 0 HB THR A 47 -2.729 5.126 -56.120 1.00 31.33 H new ATOM 0 HG1 THR A 47 -2.792 5.314 -58.468 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.869 3.299 -57.532 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.628 2.679 -56.046 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.498 2.585 -57.596 1.00 54.21 H new ATOM 703 N VAL A 48 -5.251 2.815 -54.241 1.00 1.43 N ATOM 704 CA VAL A 48 -5.252 2.226 -52.905 1.00 41.03 C ATOM 705 C VAL A 48 -4.767 0.776 -52.940 1.00 2.14 C ATOM 706 O VAL A 48 -4.456 0.234 -54.000 1.00 5.01 O ATOM 707 CB VAL A 48 -6.673 2.255 -52.287 1.00 25.31 C ATOM 708 CG1 VAL A 48 -7.205 3.683 -52.216 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.625 1.351 -53.076 1.00 31.14 C ATOM 0 H VAL A 48 -5.861 2.333 -54.901 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.574 2.822 -52.294 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.610 1.871 -51.269 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -8.204 3.678 -51.779 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -6.541 4.288 -51.598 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -7.251 4.105 -53.220 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.617 1.386 -52.625 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.683 1.696 -54.108 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -7.254 0.326 -53.057 1.00 31.14 H new ATOM 719 N HIS A 49 -4.698 0.164 -51.770 1.00 0.12 N ATOM 720 CA HIS A 49 -4.342 -1.241 -51.629 1.00 21.40 C ATOM 721 C HIS A 49 -4.893 -1.755 -50.304 1.00 62.51 C ATOM 722 O HIS A 49 -4.912 -1.024 -49.313 1.00 12.42 O ATOM 723 CB HIS A 49 -2.815 -1.415 -51.693 1.00 65.53 C ATOM 724 CG HIS A 49 -2.344 -2.827 -51.517 1.00 3.22 C ATOM 725 ND1 HIS A 49 -1.486 -3.213 -50.510 1.00 4.14 N ATOM 726 CD2 HIS A 49 -2.603 -3.947 -52.236 1.00 44.34 C ATOM 727 CE1 HIS A 49 -1.235 -4.503 -50.617 1.00 71.41 C ATOM 728 NE2 HIS A 49 -1.901 -4.974 -51.655 1.00 60.41 N ATOM 0 H HIS A 49 -4.889 0.630 -50.883 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.775 -1.817 -52.447 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -2.459 -1.044 -52.654 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.358 -0.794 -50.922 1.00 65.53 H new ATOM 0 HD2 HIS A 49 -3.242 -4.018 -53.104 1.00 44.34 H new ATOM 0 HE1 HIS A 49 -0.593 -5.077 -49.966 1.00 71.41 H new ATOM 0 HE2 HIS A 49 -1.895 -5.943 -51.973 1.00 60.41 H new ATOM 737 N TYR A 50 -5.367 -2.997 -50.292 1.00 14.34 N ATOM 738 CA TYR A 50 -5.937 -3.592 -49.086 1.00 11.42 C ATOM 739 C TYR A 50 -5.263 -4.923 -48.789 1.00 70.24 C ATOM 740 O TYR A 50 -4.752 -5.578 -49.701 1.00 63.33 O ATOM 741 CB TYR A 50 -7.447 -3.812 -49.250 1.00 61.52 C ATOM 742 CG TYR A 50 -8.226 -2.551 -49.578 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.542 -1.625 -48.588 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.646 -2.285 -50.880 1.00 44.43 C ATOM 745 CE1 TYR A 50 -9.252 -0.477 -48.883 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.355 -1.140 -51.182 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.655 -0.238 -50.181 1.00 62.13 C ATOM 748 OH TYR A 50 -10.364 0.904 -50.478 1.00 33.15 O ATOM 0 H TYR A 50 -5.368 -3.613 -51.105 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.768 -2.905 -48.257 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.613 -4.544 -50.040 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -7.843 -4.241 -48.330 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -8.227 -1.807 -47.571 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -8.413 -2.987 -51.667 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -9.490 0.230 -48.102 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.674 -0.951 -52.196 1.00 51.13 H new ATOM 0 HH TYR A 50 -10.381 1.036 -51.449 1.00 33.15 H new ATOM 758 N ASP A 51 -5.249 -5.305 -47.516 1.00 4.52 N ATOM 759 CA ASP A 51 -4.738 -6.617 -47.101 1.00 51.23 C ATOM 760 C ASP A 51 -5.682 -7.229 -46.061 1.00 52.23 C ATOM 761 O ASP A 51 -5.776 -6.741 -44.933 1.00 72.43 O ATOM 762 CB ASP A 51 -3.314 -6.481 -46.537 1.00 43.42 C ATOM 763 CG ASP A 51 -2.593 -7.817 -46.393 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.161 -8.378 -47.425 1.00 54.15 O ATOM 765 OD2 ASP A 51 -2.422 -8.298 -45.250 1.00 62.22 O ATOM 0 H ASP A 51 -5.586 -4.725 -46.747 1.00 4.52 H new ATOM 0 HA ASP A 51 -4.695 -7.278 -47.966 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -2.732 -5.831 -47.190 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.361 -5.994 -45.563 1.00 43.42 H new ATOM 770 N GLY A 52 -6.401 -8.276 -46.460 1.00 64.23 N ATOM 771 CA GLY A 52 -7.447 -8.844 -45.617 1.00 20.04 C ATOM 772 C GLY A 52 -6.916 -9.718 -44.497 1.00 41.33 C ATOM 773 O GLY A 52 -5.907 -10.411 -44.664 1.00 22.22 O ATOM 0 H GLY A 52 -6.278 -8.745 -47.357 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.035 -8.034 -45.186 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -8.122 -9.433 -46.237 1.00 20.04 H new ATOM 777 N ARG A 53 -7.619 -9.716 -43.362 1.00 44.32 N ATOM 778 CA ARG A 53 -7.178 -10.443 -42.179 1.00 1.42 C ATOM 779 C ARG A 53 -8.334 -10.646 -41.192 1.00 33.53 C ATOM 780 O ARG A 53 -9.217 -9.793 -41.053 1.00 63.13 O ATOM 781 CB ARG A 53 -6.028 -9.671 -41.516 1.00 71.31 C ATOM 782 CG ARG A 53 -5.222 -10.479 -40.504 1.00 52.10 C ATOM 783 CD ARG A 53 -3.930 -9.755 -40.142 1.00 42.02 C ATOM 784 NE ARG A 53 -3.196 -9.358 -41.350 1.00 21.24 N ATOM 785 CZ ARG A 53 -2.475 -8.243 -41.466 1.00 61.51 C ATOM 786 NH1 ARG A 53 -2.291 -7.444 -40.421 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.929 -7.927 -42.631 1.00 4.41 N ATOM 0 H ARG A 53 -8.499 -9.215 -43.242 1.00 44.32 H new ATOM 0 HA ARG A 53 -6.828 -11.431 -42.478 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.354 -9.311 -42.293 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.437 -8.793 -41.017 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -5.817 -10.643 -39.605 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -4.991 -11.461 -40.917 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -4.158 -8.873 -39.544 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -3.305 -10.403 -39.528 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.241 -9.979 -42.158 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -2.703 -7.681 -39.519 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -1.737 -6.593 -40.521 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -2.061 -8.537 -43.438 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -1.377 -7.074 -42.721 1.00 4.41 H new ATOM 801 N PHE A 54 -8.333 -11.791 -40.522 1.00 54.13 N ATOM 802 CA PHE A 54 -9.334 -12.102 -39.506 1.00 71.03 C ATOM 803 C PHE A 54 -8.929 -11.477 -38.170 1.00 14.50 C ATOM 804 O PHE A 54 -7.737 -11.369 -37.874 1.00 62.12 O ATOM 805 CB PHE A 54 -9.478 -13.627 -39.350 1.00 75.12 C ATOM 806 CG PHE A 54 -9.953 -14.330 -40.601 1.00 4.21 C ATOM 807 CD1 PHE A 54 -9.054 -14.709 -41.588 1.00 10.32 C ATOM 808 CD2 PHE A 54 -11.300 -14.609 -40.788 1.00 43.03 C ATOM 809 CE1 PHE A 54 -9.487 -15.352 -42.732 1.00 10.31 C ATOM 810 CE2 PHE A 54 -11.737 -15.251 -41.932 1.00 64.24 C ATOM 811 CZ PHE A 54 -10.831 -15.623 -42.904 1.00 33.43 C ATOM 0 H PHE A 54 -7.643 -12.528 -40.665 1.00 54.13 H new ATOM 0 HA PHE A 54 -10.293 -11.689 -39.818 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -8.515 -14.044 -39.054 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -10.178 -13.835 -38.541 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -8.002 -14.499 -41.460 1.00 10.32 H new ATOM 0 HD2 PHE A 54 -12.015 -14.321 -40.031 1.00 43.03 H new ATOM 0 HE1 PHE A 54 -8.776 -15.642 -43.491 1.00 10.31 H new ATOM 0 HE2 PHE A 54 -12.788 -15.461 -42.065 1.00 64.24 H new ATOM 0 HZ PHE A 54 -11.172 -16.125 -43.797 1.00 33.43 H new ATOM 821 N PRO A 55 -9.908 -11.064 -37.337 1.00 32.51 N ATOM 822 CA PRO A 55 -9.624 -10.471 -36.019 1.00 12.25 C ATOM 823 C PRO A 55 -8.915 -11.465 -35.097 1.00 74.21 C ATOM 824 O PRO A 55 -8.310 -11.083 -34.093 1.00 2.34 O ATOM 825 CB PRO A 55 -11.018 -10.108 -35.475 1.00 42.22 C ATOM 826 CG PRO A 55 -11.966 -10.971 -36.240 1.00 14.43 C ATOM 827 CD PRO A 55 -11.358 -11.137 -37.607 1.00 41.45 C ATOM 0 HA PRO A 55 -8.956 -9.612 -36.083 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -11.086 -10.299 -34.404 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -11.237 -9.051 -35.625 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -12.098 -11.936 -35.751 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.951 -10.509 -36.304 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -11.637 -12.089 -38.060 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.681 -10.352 -38.291 1.00 41.45 H new ATOM 835 N ASP A 56 -9.004 -12.743 -35.454 1.00 72.30 N ATOM 836 CA ASP A 56 -8.353 -13.814 -34.704 1.00 2.21 C ATOM 837 C ASP A 56 -6.839 -13.754 -34.893 1.00 31.10 C ATOM 838 O ASP A 56 -6.076 -14.211 -34.036 1.00 51.45 O ATOM 839 CB ASP A 56 -8.881 -15.177 -35.171 1.00 33.21 C ATOM 840 CG ASP A 56 -10.397 -15.264 -35.115 1.00 3.34 C ATOM 841 OD1 ASP A 56 -11.057 -14.797 -36.069 1.00 1.05 O ATOM 842 OD2 ASP A 56 -10.937 -15.785 -34.114 1.00 33.45 O ATOM 0 H ASP A 56 -9.527 -13.065 -36.268 1.00 72.30 H new ATOM 0 HA ASP A 56 -8.580 -13.684 -33.646 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -8.547 -15.362 -36.192 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -8.452 -15.962 -34.548 1.00 33.21 H new ATOM 847 N GLY A 57 -6.414 -13.184 -36.020 1.00 5.43 N ATOM 848 CA GLY A 57 -4.995 -13.087 -36.334 1.00 3.42 C ATOM 849 C GLY A 57 -4.678 -13.664 -37.702 1.00 52.54 C ATOM 850 O GLY A 57 -3.858 -13.114 -38.445 1.00 13.40 O ATOM 0 H GLY A 57 -7.032 -12.785 -36.726 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -4.686 -12.042 -36.300 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -4.418 -13.615 -35.575 1.00 3.42 H new ATOM 854 N LYS A 58 -5.328 -14.781 -38.023 1.00 22.23 N ATOM 855 CA LYS A 58 -5.159 -15.460 -39.310 1.00 64.14 C ATOM 856 C LYS A 58 -5.469 -14.523 -40.485 1.00 44.42 C ATOM 857 O LYS A 58 -6.311 -13.634 -40.373 1.00 32.12 O ATOM 858 CB LYS A 58 -6.095 -16.680 -39.380 1.00 2.04 C ATOM 859 CG LYS A 58 -6.055 -17.424 -40.716 1.00 64.13 C ATOM 860 CD LYS A 58 -7.160 -18.474 -40.824 1.00 2.12 C ATOM 861 CE LYS A 58 -7.023 -19.569 -39.772 1.00 51.22 C ATOM 862 NZ LYS A 58 -5.745 -20.317 -39.904 1.00 12.14 N ATOM 0 H LYS A 58 -5.988 -15.243 -37.398 1.00 22.23 H new ATOM 0 HA LYS A 58 -4.119 -15.776 -39.386 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -5.830 -17.374 -38.582 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -7.117 -16.352 -39.190 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -6.155 -16.708 -41.532 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -5.085 -17.907 -40.833 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -8.130 -17.989 -40.716 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -7.136 -18.922 -41.817 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -7.081 -19.125 -38.778 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -7.859 -20.263 -39.861 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -5.760 -21.144 -39.273 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -5.628 -20.634 -40.888 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -4.951 -19.697 -39.644 1.00 12.14 H new ATOM 876 N GLN A 59 -4.785 -14.733 -41.606 1.00 62.31 N ATOM 877 CA GLN A 59 -5.088 -14.025 -42.848 1.00 30.32 C ATOM 878 C GLN A 59 -5.200 -15.035 -43.989 1.00 0.55 C ATOM 879 O GLN A 59 -4.450 -16.011 -44.034 1.00 71.44 O ATOM 880 CB GLN A 59 -4.017 -12.963 -43.149 1.00 41.23 C ATOM 881 CG GLN A 59 -2.627 -13.525 -43.417 1.00 10.35 C ATOM 882 CD GLN A 59 -1.565 -12.443 -43.478 1.00 72.33 C ATOM 883 OE1 GLN A 59 -0.945 -12.110 -42.468 1.00 24.21 O ATOM 884 NE2 GLN A 59 -1.364 -11.871 -44.653 1.00 55.00 N ATOM 0 H GLN A 59 -4.011 -15.393 -41.680 1.00 62.31 H new ATOM 0 HA GLN A 59 -6.039 -13.504 -42.742 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -4.333 -12.382 -44.015 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -3.960 -12.274 -42.306 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -2.370 -14.238 -42.634 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -2.636 -14.074 -44.358 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -1.898 -12.176 -45.467 1.00 55.00 H new ATOM 0 HE22 GLN A 59 -0.674 -11.125 -44.746 1.00 55.00 H new ATOM 893 N PHE A 60 -6.146 -14.810 -44.893 1.00 4.41 N ATOM 894 CA PHE A 60 -6.442 -15.774 -45.954 1.00 50.42 C ATOM 895 C PHE A 60 -5.443 -15.673 -47.109 1.00 13.13 C ATOM 896 O PHE A 60 -5.043 -16.689 -47.677 1.00 51.22 O ATOM 897 CB PHE A 60 -7.885 -15.595 -46.460 1.00 41.42 C ATOM 898 CG PHE A 60 -8.246 -14.175 -46.837 1.00 61.13 C ATOM 899 CD1 PHE A 60 -8.037 -13.703 -48.126 1.00 12.31 C ATOM 900 CD2 PHE A 60 -8.804 -13.315 -45.900 1.00 40.54 C ATOM 901 CE1 PHE A 60 -8.374 -12.409 -48.471 1.00 10.14 C ATOM 902 CE2 PHE A 60 -9.144 -12.021 -46.241 1.00 73.53 C ATOM 903 CZ PHE A 60 -8.928 -11.566 -47.527 1.00 13.11 C ATOM 0 H PHE A 60 -6.723 -13.969 -44.915 1.00 4.41 H new ATOM 0 HA PHE A 60 -6.344 -16.773 -45.528 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -8.034 -16.237 -47.328 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -8.573 -15.938 -45.687 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -7.605 -14.357 -48.869 1.00 12.31 H new ATOM 0 HD2 PHE A 60 -8.974 -13.663 -44.892 1.00 40.54 H new ATOM 0 HE1 PHE A 60 -8.205 -12.056 -49.478 1.00 10.14 H new ATOM 0 HE2 PHE A 60 -9.579 -11.364 -45.502 1.00 73.53 H new ATOM 0 HZ PHE A 60 -9.192 -10.553 -47.794 1.00 13.11 H new ATOM 913 N ASP A 61 -5.040 -14.451 -47.446 1.00 72.13 N ATOM 914 CA ASP A 61 -4.101 -14.224 -48.548 1.00 21.25 C ATOM 915 C ASP A 61 -3.314 -12.937 -48.317 1.00 45.30 C ATOM 916 O ASP A 61 -3.892 -11.908 -47.962 1.00 20.32 O ATOM 917 CB ASP A 61 -4.847 -14.151 -49.893 1.00 71.44 C ATOM 918 CG ASP A 61 -3.913 -13.924 -51.077 1.00 31.53 C ATOM 919 OD1 ASP A 61 -3.402 -14.922 -51.641 1.00 42.41 O ATOM 920 OD2 ASP A 61 -3.688 -12.752 -51.456 1.00 45.10 O ATOM 0 H ASP A 61 -5.347 -13.601 -46.974 1.00 72.13 H new ATOM 0 HA ASP A 61 -3.406 -15.063 -48.582 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -5.401 -15.077 -50.046 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -5.579 -13.344 -49.854 1.00 71.44 H new ATOM 925 N SER A 62 -2.001 -13.004 -48.509 1.00 2.52 N ATOM 926 CA SER A 62 -1.142 -11.840 -48.341 1.00 22.13 C ATOM 927 C SER A 62 -1.204 -10.977 -49.599 1.00 22.13 C ATOM 928 O SER A 62 -0.437 -11.172 -50.546 1.00 25.20 O ATOM 929 CB SER A 62 0.301 -12.274 -48.043 1.00 73.41 C ATOM 930 OG SER A 62 1.116 -11.165 -47.700 1.00 51.41 O ATOM 0 H SER A 62 -1.509 -13.855 -48.782 1.00 2.52 H new ATOM 0 HA SER A 62 -1.494 -11.252 -47.493 1.00 22.13 H new ATOM 0 HB2 SER A 62 0.304 -12.996 -47.226 1.00 73.41 H new ATOM 0 HB3 SER A 62 0.718 -12.778 -48.915 1.00 73.41 H new ATOM 0 HG SER A 62 1.097 -11.033 -46.729 1.00 51.41 H new ATOM 936 N SER A 63 -2.131 -10.025 -49.599 1.00 2.54 N ATOM 937 CA SER A 63 -2.381 -9.189 -50.763 1.00 61.15 C ATOM 938 C SER A 63 -1.190 -8.269 -51.039 1.00 30.33 C ATOM 939 O SER A 63 -1.060 -7.704 -52.130 1.00 20.53 O ATOM 940 CB SER A 63 -3.662 -8.373 -50.547 1.00 5.12 C ATOM 941 OG SER A 63 -4.766 -9.222 -50.265 1.00 11.23 O ATOM 0 H SER A 63 -2.725 -9.814 -48.797 1.00 2.54 H new ATOM 0 HA SER A 63 -2.513 -9.829 -51.635 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.517 -7.674 -49.724 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.873 -7.779 -51.436 1.00 5.12 H new ATOM 0 HG SER A 63 -5.570 -8.679 -50.130 1.00 11.23 H new ATOM 947 N ARG A 64 -0.328 -8.113 -50.036 1.00 62.05 N ATOM 948 CA ARG A 64 0.896 -7.329 -50.186 1.00 51.31 C ATOM 949 C ARG A 64 1.939 -8.092 -51.010 1.00 11.31 C ATOM 950 O ARG A 64 2.715 -7.484 -51.744 1.00 41.21 O ATOM 951 CB ARG A 64 1.459 -6.933 -48.797 1.00 11.31 C ATOM 952 CG ARG A 64 1.808 -8.108 -47.880 1.00 31.34 C ATOM 953 CD ARG A 64 3.236 -8.616 -48.086 1.00 61.25 C ATOM 954 NE ARG A 64 3.524 -9.792 -47.258 1.00 63.21 N ATOM 955 CZ ARG A 64 4.600 -9.921 -46.475 1.00 44.35 C ATOM 956 NH1 ARG A 64 5.512 -8.957 -46.421 1.00 70.45 N ATOM 957 NH2 ARG A 64 4.765 -11.022 -45.754 1.00 74.42 N ATOM 0 H ARG A 64 -0.455 -8.520 -49.109 1.00 62.05 H new ATOM 0 HA ARG A 64 0.654 -6.414 -50.727 1.00 51.31 H new ATOM 0 HB2 ARG A 64 2.354 -6.328 -48.944 1.00 11.31 H new ATOM 0 HB3 ARG A 64 0.727 -6.302 -48.292 1.00 11.31 H new ATOM 0 HG2 ARG A 64 1.682 -7.802 -46.841 1.00 31.34 H new ATOM 0 HG3 ARG A 64 1.108 -8.924 -48.059 1.00 31.34 H new ATOM 0 HD2 ARG A 64 3.384 -8.867 -49.136 1.00 61.25 H new ATOM 0 HD3 ARG A 64 3.942 -7.821 -47.846 1.00 61.25 H new ATOM 0 HE ARG A 64 2.858 -10.564 -47.281 1.00 63.21 H new ATOM 0 HH11 ARG A 64 5.394 -8.111 -46.979 1.00 70.45 H new ATOM 0 HH12 ARG A 64 6.330 -9.062 -45.821 1.00 70.45 H new ATOM 0 HH21 ARG A 64 4.072 -11.769 -45.797 1.00 74.42 H new ATOM 0 HH22 ARG A 64 5.585 -11.122 -45.156 1.00 74.42 H new ATOM 971 N SER A 65 1.925 -9.421 -50.912 1.00 10.31 N ATOM 972 CA SER A 65 2.927 -10.259 -51.576 1.00 43.24 C ATOM 973 C SER A 65 2.824 -10.119 -53.100 1.00 30.11 C ATOM 974 O SER A 65 3.833 -9.941 -53.787 1.00 40.21 O ATOM 975 CB SER A 65 2.754 -11.728 -51.152 1.00 13.31 C ATOM 976 OG SER A 65 3.845 -12.539 -51.580 1.00 52.33 O ATOM 0 H SER A 65 1.230 -9.943 -50.378 1.00 10.31 H new ATOM 0 HA SER A 65 3.919 -9.924 -51.272 1.00 43.24 H new ATOM 0 HB2 SER A 65 2.664 -11.784 -50.067 1.00 13.31 H new ATOM 0 HB3 SER A 65 1.826 -12.119 -51.569 1.00 13.31 H new ATOM 0 HG SER A 65 3.699 -13.464 -51.290 1.00 52.33 H new ATOM 982 N ARG A 66 1.601 -10.185 -53.622 1.00 45.31 N ATOM 983 CA ARG A 66 1.369 -10.046 -55.065 1.00 14.00 C ATOM 984 C ARG A 66 1.483 -8.587 -55.511 1.00 1.23 C ATOM 985 O ARG A 66 1.542 -8.302 -56.707 1.00 33.32 O ATOM 986 CB ARG A 66 0.004 -10.637 -55.457 1.00 41.14 C ATOM 987 CG ARG A 66 -1.114 -10.351 -54.458 1.00 42.33 C ATOM 988 CD ARG A 66 -2.439 -10.975 -54.889 1.00 1.51 C ATOM 989 NE ARG A 66 -3.357 -11.133 -53.757 1.00 14.23 N ATOM 990 CZ ARG A 66 -4.599 -10.649 -53.705 1.00 13.50 C ATOM 991 NH1 ARG A 66 -5.114 -9.988 -54.735 1.00 2.55 N ATOM 992 NH2 ARG A 66 -5.334 -10.858 -52.622 1.00 75.44 N ATOM 0 H ARG A 66 0.755 -10.333 -53.072 1.00 45.31 H new ATOM 0 HA ARG A 66 2.146 -10.609 -55.583 1.00 14.00 H new ATOM 0 HB2 ARG A 66 -0.284 -10.241 -56.431 1.00 41.14 H new ATOM 0 HB3 ARG A 66 0.107 -11.716 -55.570 1.00 41.14 H new ATOM 0 HG2 ARG A 66 -0.833 -10.738 -53.478 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -1.238 -9.273 -54.352 1.00 42.33 H new ATOM 0 HD2 ARG A 66 -2.905 -10.350 -55.651 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -2.252 -11.947 -55.345 1.00 1.51 H new ATOM 0 HE ARG A 66 -3.020 -11.653 -52.947 1.00 14.23 H new ATOM 0 HH11 ARG A 66 -4.559 -9.845 -55.579 1.00 2.55 H new ATOM 0 HH12 ARG A 66 -6.065 -9.623 -54.683 1.00 2.55 H new ATOM 0 HH21 ARG A 66 -4.949 -11.385 -51.838 1.00 75.44 H new ATOM 0 HH22 ARG A 66 -6.285 -10.492 -52.572 1.00 75.44 H new ATOM 1006 N GLY A 67 1.508 -7.675 -54.537 1.00 34.51 N ATOM 1007 CA GLY A 67 1.742 -6.261 -54.810 1.00 34.10 C ATOM 1008 C GLY A 67 0.819 -5.679 -55.869 1.00 63.33 C ATOM 1009 O GLY A 67 1.235 -4.838 -56.665 1.00 1.24 O ATOM 0 H GLY A 67 1.368 -7.894 -53.551 1.00 34.51 H new ATOM 0 HA2 GLY A 67 1.620 -5.697 -53.885 1.00 34.10 H new ATOM 0 HA3 GLY A 67 2.776 -6.129 -55.130 1.00 34.10 H new ATOM 1013 N LYS A 68 -0.432 -6.125 -55.882 1.00 75.34 N ATOM 1014 CA LYS A 68 -1.416 -5.621 -56.837 1.00 45.14 C ATOM 1015 C LYS A 68 -2.185 -4.446 -56.231 1.00 23.21 C ATOM 1016 O LYS A 68 -2.911 -4.618 -55.249 1.00 4.34 O ATOM 1017 CB LYS A 68 -2.386 -6.742 -57.252 1.00 40.24 C ATOM 1018 CG LYS A 68 -3.467 -6.300 -58.243 1.00 60.33 C ATOM 1019 CD LYS A 68 -2.876 -5.719 -59.528 1.00 74.22 C ATOM 1020 CE LYS A 68 -2.029 -6.732 -60.292 1.00 64.14 C ATOM 1021 NZ LYS A 68 -1.429 -6.141 -61.521 1.00 71.10 N ATOM 0 H LYS A 68 -0.790 -6.834 -55.243 1.00 75.34 H new ATOM 0 HA LYS A 68 -0.892 -5.273 -57.727 1.00 45.14 H new ATOM 0 HB2 LYS A 68 -1.814 -7.557 -57.695 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -2.868 -7.140 -56.359 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -4.100 -7.152 -58.490 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -4.106 -5.554 -57.771 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -3.684 -5.369 -60.170 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -2.265 -4.851 -59.283 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -1.236 -7.104 -59.644 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -2.646 -7.588 -60.565 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -0.861 -6.861 -62.011 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -2.186 -5.809 -62.152 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -0.820 -5.340 -61.259 1.00 71.10 H new ATOM 1035 N PRO A 69 -2.007 -3.227 -56.785 1.00 1.43 N ATOM 1036 CA PRO A 69 -2.720 -2.033 -56.339 1.00 41.05 C ATOM 1037 C PRO A 69 -4.120 -1.944 -56.948 1.00 63.34 C ATOM 1038 O PRO A 69 -4.364 -2.436 -58.054 1.00 73.21 O ATOM 1039 CB PRO A 69 -1.834 -0.866 -56.831 1.00 65.54 C ATOM 1040 CG PRO A 69 -0.674 -1.496 -57.548 1.00 33.42 C ATOM 1041 CD PRO A 69 -1.089 -2.902 -57.882 1.00 34.41 C ATOM 0 HA PRO A 69 -2.874 -2.028 -55.260 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -2.392 -0.207 -57.496 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -1.491 -0.258 -55.994 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -0.429 -0.939 -58.452 1.00 33.42 H new ATOM 0 HG3 PRO A 69 0.217 -1.494 -56.920 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -1.580 -2.961 -58.854 1.00 34.41 H new ATOM 0 HD3 PRO A 69 -0.237 -3.581 -57.913 1.00 34.41 H new ATOM 1049 N PHE A 70 -5.028 -1.317 -56.215 1.00 41.12 N ATOM 1050 CA PHE A 70 -6.398 -1.106 -56.667 1.00 52.04 C ATOM 1051 C PHE A 70 -6.633 0.390 -56.852 1.00 55.23 C ATOM 1052 O PHE A 70 -5.885 1.204 -56.310 1.00 31.10 O ATOM 1053 CB PHE A 70 -7.388 -1.677 -55.640 1.00 51.25 C ATOM 1054 CG PHE A 70 -7.109 -3.113 -55.263 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -7.574 -4.156 -56.050 1.00 54.02 C ATOM 1056 CD2 PHE A 70 -6.377 -3.416 -54.122 1.00 50.33 C ATOM 1057 CE1 PHE A 70 -7.315 -5.470 -55.707 1.00 42.20 C ATOM 1058 CE2 PHE A 70 -6.117 -4.727 -53.775 1.00 71.23 C ATOM 1059 CZ PHE A 70 -6.586 -5.756 -54.568 1.00 20.44 C ATOM 0 H PHE A 70 -4.836 -0.939 -55.287 1.00 41.12 H new ATOM 0 HA PHE A 70 -6.554 -1.620 -57.616 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -7.360 -1.062 -54.740 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -8.398 -1.606 -56.043 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -8.145 -3.939 -56.941 1.00 54.02 H new ATOM 0 HD2 PHE A 70 -6.006 -2.616 -53.498 1.00 50.33 H new ATOM 0 HE1 PHE A 70 -7.682 -6.273 -56.329 1.00 42.20 H new ATOM 0 HE2 PHE A 70 -5.547 -4.948 -52.884 1.00 71.23 H new ATOM 0 HZ PHE A 70 -6.384 -6.782 -54.299 1.00 20.44 H new ATOM 1069 N GLN A 71 -7.654 0.759 -57.616 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.967 2.167 -57.845 1.00 52.35 C ATOM 1071 C GLN A 71 -9.476 2.375 -57.841 1.00 12.44 C ATOM 1072 O GLN A 71 -10.231 1.485 -58.245 1.00 73.44 O ATOM 1073 CB GLN A 71 -7.374 2.648 -59.183 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.868 2.436 -59.309 1.00 24.22 C ATOM 1075 CD GLN A 71 -5.293 3.004 -60.594 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -5.262 2.333 -61.625 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -4.819 4.239 -60.538 1.00 75.03 N ATOM 0 H GLN A 71 -8.279 0.105 -58.087 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.523 2.752 -57.040 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.873 2.125 -59.998 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.592 3.709 -59.304 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -5.369 2.900 -58.458 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -5.652 1.369 -59.262 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -4.863 4.763 -59.664 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -4.410 4.666 -61.369 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.910 3.537 -57.365 1.00 73.33 N ATOM 1087 CA PHE A 72 -11.328 3.897 -57.386 1.00 2.55 C ATOM 1088 C PHE A 72 -11.501 5.381 -57.085 1.00 20.34 C ATOM 1089 O PHE A 72 -10.594 6.021 -56.561 1.00 61.22 O ATOM 1090 CB PHE A 72 -12.138 3.053 -56.382 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.882 3.378 -54.927 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.835 2.786 -54.237 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.700 4.271 -54.248 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.612 3.077 -52.905 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.479 4.566 -52.917 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.434 3.968 -52.245 1.00 32.03 C ATOM 0 H PHE A 72 -9.302 4.248 -56.959 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.710 3.688 -58.385 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -13.200 3.189 -56.588 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.913 2.000 -56.549 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -10.186 2.089 -54.747 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.521 4.742 -54.768 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.794 2.607 -52.380 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -13.124 5.264 -52.403 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.259 4.196 -51.204 1.00 32.03 H new ATOM 1106 N THR A 73 -12.658 5.924 -57.433 1.00 51.11 N ATOM 1107 CA THR A 73 -12.964 7.321 -57.154 1.00 1.20 C ATOM 1108 C THR A 73 -13.279 7.507 -55.665 1.00 62.13 C ATOM 1109 O THR A 73 -14.287 7.004 -55.171 1.00 74.23 O ATOM 1110 CB THR A 73 -14.159 7.796 -58.007 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.887 7.549 -59.398 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.439 9.280 -57.786 1.00 75.20 C ATOM 0 H THR A 73 -13.403 5.417 -57.911 1.00 51.11 H new ATOM 0 HA THR A 73 -12.091 7.921 -57.411 1.00 1.20 H new ATOM 0 HB THR A 73 -15.044 7.237 -57.702 1.00 52.41 H new ATOM 0 HG1 THR A 73 -14.647 7.849 -59.938 1.00 54.54 H new ATOM 0 HG21 THR A 73 -15.286 9.586 -58.400 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.671 9.454 -56.735 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.560 9.862 -58.065 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.408 8.222 -54.957 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.550 8.399 -53.512 1.00 2.01 C ATOM 1122 C LEU A 74 -13.777 9.251 -53.188 1.00 50.22 C ATOM 1123 O LEU A 74 -14.022 10.268 -53.843 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.290 9.057 -52.933 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.256 9.186 -51.400 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -11.283 7.809 -50.740 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.031 9.983 -50.954 1.00 40.31 C ATOM 0 H LEU A 74 -11.596 8.689 -55.360 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.681 7.416 -53.059 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.421 8.481 -53.251 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.189 10.052 -53.366 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.147 9.728 -51.082 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -11.258 7.924 -49.656 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -12.194 7.285 -51.028 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -10.416 7.233 -51.063 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.025 10.063 -49.867 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.126 9.474 -51.285 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.067 10.981 -51.391 1.00 40.31 H new ATOM 1139 N GLY A 75 -14.538 8.831 -52.181 1.00 21.12 N ATOM 1140 CA GLY A 75 -15.710 9.577 -51.759 1.00 51.53 C ATOM 1141 C GLY A 75 -16.870 9.396 -52.715 1.00 33.31 C ATOM 1142 O GLY A 75 -17.598 10.350 -53.014 1.00 41.10 O ATOM 0 H GLY A 75 -14.361 7.980 -51.646 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.007 9.252 -50.762 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -15.460 10.636 -51.688 1.00 51.53 H new ATOM 1146 N ALA A 76 -17.043 8.171 -53.194 1.00 23.41 N ATOM 1147 CA ALA A 76 -18.106 7.844 -54.141 1.00 10.02 C ATOM 1148 C ALA A 76 -18.605 6.425 -53.906 1.00 2.44 C ATOM 1149 O ALA A 76 -18.088 5.714 -53.042 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.604 8.013 -55.574 1.00 13.12 C ATOM 0 H ALA A 76 -16.454 7.378 -52.940 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.940 8.528 -53.986 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -18.405 7.767 -56.271 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -17.291 9.045 -55.731 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.757 7.348 -55.744 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.601 6.009 -54.681 1.00 45.30 N ATOM 1157 CA GLY A 77 -20.155 4.672 -54.537 1.00 54.35 C ATOM 1158 C GLY A 77 -19.344 3.632 -55.288 1.00 33.32 C ATOM 1159 O GLY A 77 -19.900 2.787 -55.994 1.00 54.41 O ATOM 0 H GLY A 77 -20.037 6.575 -55.409 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -20.192 4.408 -53.480 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -21.181 4.664 -54.904 1.00 54.35 H new ATOM 1163 N GLU A 78 -18.025 3.694 -55.133 1.00 32.55 N ATOM 1164 CA GLU A 78 -17.110 2.794 -55.832 1.00 75.44 C ATOM 1165 C GLU A 78 -16.946 1.482 -55.073 1.00 54.02 C ATOM 1166 O GLU A 78 -17.029 0.397 -55.653 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.749 3.478 -55.990 1.00 2.50 C ATOM 1168 CG GLU A 78 -15.770 4.692 -56.909 1.00 4.04 C ATOM 1169 CD GLU A 78 -15.890 4.310 -58.374 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -17.022 4.083 -58.851 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -14.846 4.230 -59.057 1.00 75.43 O ATOM 0 H GLU A 78 -17.561 4.366 -54.522 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.526 2.567 -56.813 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.392 3.785 -55.007 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -15.033 2.754 -56.378 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.605 5.337 -56.635 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -14.859 5.271 -56.761 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.708 1.595 -53.773 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.525 0.437 -52.906 1.00 1.34 C ATOM 1180 C VAL A 79 -17.365 0.602 -51.646 1.00 20.50 C ATOM 1181 O VAL A 79 -18.045 1.615 -51.477 1.00 12.22 O ATOM 1182 CB VAL A 79 -15.036 0.242 -52.509 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -14.172 -0.041 -53.734 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.512 1.463 -51.753 1.00 32.01 C ATOM 0 H VAL A 79 -16.636 2.490 -53.290 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.845 -0.445 -53.460 1.00 1.34 H new ATOM 0 HB VAL A 79 -14.978 -0.623 -51.848 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -13.135 -0.173 -53.425 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -14.523 -0.949 -54.225 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -14.240 0.796 -54.428 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.467 1.304 -51.485 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -14.594 2.346 -52.387 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -15.101 1.610 -50.847 1.00 32.01 H new ATOM 1194 N ILE A 80 -17.326 -0.401 -50.777 1.00 75.42 N ATOM 1195 CA ILE A 80 -18.030 -0.333 -49.499 1.00 23.41 C ATOM 1196 C ILE A 80 -17.510 0.828 -48.646 1.00 60.52 C ATOM 1197 O ILE A 80 -16.308 1.124 -48.631 1.00 13.14 O ATOM 1198 CB ILE A 80 -17.918 -1.660 -48.708 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -16.447 -2.076 -48.560 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -18.728 -2.758 -49.392 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -16.241 -3.385 -47.822 1.00 43.25 C ATOM 0 H ILE A 80 -16.816 -1.270 -50.932 1.00 75.42 H new ATOM 0 HA ILE A 80 -19.082 -0.162 -49.726 1.00 23.41 H new ATOM 0 HB ILE A 80 -18.328 -1.506 -47.710 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -16.003 -2.158 -49.552 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -15.909 -1.287 -48.034 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -18.639 -3.684 -48.824 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -19.776 -2.461 -49.440 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -18.349 -2.914 -50.402 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -15.175 -3.605 -47.762 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -16.652 -3.304 -46.816 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -16.747 -4.188 -48.357 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.430 1.469 -47.930 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.132 2.681 -47.167 1.00 11.25 C ATOM 1215 C LYS A 81 -17.028 2.449 -46.141 1.00 2.21 C ATOM 1216 O LYS A 81 -16.272 3.368 -45.818 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.403 3.195 -46.478 1.00 0.11 C ATOM 1218 CG LYS A 81 -20.538 3.488 -47.458 1.00 41.11 C ATOM 1219 CD LYS A 81 -20.160 4.578 -48.464 1.00 62.14 C ATOM 1220 CE LYS A 81 -21.196 4.718 -49.576 1.00 73.31 C ATOM 1221 NZ LYS A 81 -22.566 4.951 -49.048 1.00 30.33 N ATOM 0 H LYS A 81 -19.401 1.165 -47.861 1.00 23.20 H new ATOM 0 HA LYS A 81 -17.772 3.435 -47.868 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -19.740 2.456 -45.751 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -19.167 4.103 -45.923 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -20.799 2.575 -47.994 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -21.424 3.797 -46.904 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -20.056 5.530 -47.944 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -19.189 4.346 -48.901 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -20.915 5.545 -50.228 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -21.194 3.815 -50.187 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -23.201 5.207 -49.831 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -22.913 4.085 -48.590 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -22.543 5.725 -48.354 1.00 30.33 H new ATOM 1235 N GLY A 82 -16.942 1.221 -45.628 1.00 34.43 N ATOM 1236 CA GLY A 82 -15.881 0.874 -44.696 1.00 31.53 C ATOM 1237 C GLY A 82 -14.508 1.125 -45.293 1.00 11.44 C ATOM 1238 O GLY A 82 -13.673 1.809 -44.694 1.00 11.05 O ATOM 0 H GLY A 82 -17.588 0.461 -45.842 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -15.993 1.458 -43.782 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -15.970 -0.176 -44.417 1.00 31.53 H new ATOM 1242 N TRP A 83 -14.293 0.594 -46.497 1.00 20.04 N ATOM 1243 CA TRP A 83 -13.018 0.746 -47.192 1.00 54.32 C ATOM 1244 C TRP A 83 -12.814 2.193 -47.631 1.00 71.34 C ATOM 1245 O TRP A 83 -11.748 2.768 -47.403 1.00 52.20 O ATOM 1246 CB TRP A 83 -12.951 -0.184 -48.414 1.00 1.15 C ATOM 1247 CG TRP A 83 -12.848 -1.643 -48.071 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -12.838 -2.200 -46.824 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -12.733 -2.732 -48.995 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.730 -3.565 -46.917 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -12.663 -3.916 -48.239 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -12.687 -2.820 -50.391 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -12.547 -5.172 -48.830 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -12.570 -4.067 -50.976 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -12.503 -5.230 -50.195 1.00 54.32 C ATOM 0 H TRP A 83 -14.989 0.054 -47.011 1.00 20.04 H new ATOM 0 HA TRP A 83 -12.223 0.473 -46.499 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -13.840 -0.028 -49.025 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -12.092 0.096 -49.023 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -12.905 -1.647 -45.899 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -12.704 -4.213 -46.129 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -12.742 -1.930 -51.000 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -12.494 -6.069 -48.231 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -12.530 -4.147 -52.052 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -12.415 -6.190 -50.682 1.00 54.32 H new ATOM 1266 N ASP A 84 -13.843 2.773 -48.247 1.00 72.43 N ATOM 1267 CA ASP A 84 -13.762 4.142 -48.769 1.00 32.24 C ATOM 1268 C ASP A 84 -13.322 5.123 -47.680 1.00 32.32 C ATOM 1269 O ASP A 84 -12.319 5.826 -47.825 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.122 4.570 -49.347 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.137 6.020 -49.824 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -14.785 6.272 -50.995 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -15.516 6.909 -49.028 1.00 3.24 O ATOM 0 H ASP A 84 -14.744 2.319 -48.398 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.015 4.158 -49.562 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -15.378 3.916 -50.181 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -15.892 4.435 -48.588 1.00 51.14 H new ATOM 1278 N GLN A 85 -14.052 5.130 -46.570 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.766 6.044 -45.467 1.00 73.31 C ATOM 1280 C GLN A 85 -12.491 5.620 -44.737 1.00 50.41 C ATOM 1281 O GLN A 85 -11.680 6.468 -44.334 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.962 6.103 -44.501 1.00 11.22 C ATOM 1283 CG GLN A 85 -16.243 6.626 -45.154 1.00 25.14 C ATOM 1284 CD GLN A 85 -17.430 6.666 -44.205 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -17.277 6.842 -42.995 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -18.629 6.520 -44.750 1.00 2.41 N ATOM 0 H GLN A 85 -14.848 4.512 -46.409 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.605 7.043 -45.872 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -15.147 5.106 -44.102 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.706 6.742 -43.656 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -16.062 7.629 -45.540 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -16.491 5.995 -46.008 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -18.718 6.376 -45.756 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -19.463 6.552 -44.164 1.00 2.41 H new ATOM 1295 N GLY A 86 -12.311 4.305 -44.592 1.00 70.40 N ATOM 1296 CA GLY A 86 -11.122 3.777 -43.947 1.00 62.34 C ATOM 1297 C GLY A 86 -9.847 4.290 -44.587 1.00 13.43 C ATOM 1298 O GLY A 86 -8.948 4.768 -43.898 1.00 1.43 O ATOM 0 H GLY A 86 -12.972 3.597 -44.912 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -11.132 4.050 -42.892 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -11.138 2.688 -43.995 1.00 62.34 H new ATOM 1302 N VAL A 87 -9.766 4.186 -45.908 1.00 54.13 N ATOM 1303 CA VAL A 87 -8.610 4.687 -46.641 1.00 50.24 C ATOM 1304 C VAL A 87 -8.649 6.217 -46.749 1.00 54.40 C ATOM 1305 O VAL A 87 -7.610 6.874 -46.784 1.00 10.11 O ATOM 1306 CB VAL A 87 -8.503 4.047 -48.053 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -9.619 4.533 -48.977 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -7.128 4.310 -48.663 1.00 62.31 C ATOM 0 H VAL A 87 -10.485 3.760 -46.492 1.00 54.13 H new ATOM 0 HA VAL A 87 -7.722 4.401 -46.077 1.00 50.24 H new ATOM 0 HB VAL A 87 -8.624 2.970 -47.939 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -9.512 4.064 -49.955 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -10.586 4.266 -48.551 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -9.556 5.616 -49.085 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -7.075 3.853 -49.651 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -6.969 5.385 -48.751 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -6.358 3.880 -48.023 1.00 62.31 H new ATOM 1318 N ALA A 88 -9.853 6.787 -46.797 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.009 8.239 -46.904 1.00 63.54 C ATOM 1320 C ALA A 88 -9.422 8.963 -45.691 1.00 61.41 C ATOM 1321 O ALA A 88 -8.898 10.073 -45.812 1.00 62.12 O ATOM 1322 CB ALA A 88 -11.478 8.606 -47.071 1.00 72.34 C ATOM 0 H ALA A 88 -10.731 6.269 -46.764 1.00 43.42 H new ATOM 0 HA ALA A 88 -9.456 8.562 -47.786 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -11.576 9.689 -47.149 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -11.869 8.140 -47.976 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.042 8.252 -46.208 1.00 72.34 H new ATOM 1328 N THR A 89 -9.508 8.333 -44.522 1.00 71.10 N ATOM 1329 CA THR A 89 -9.050 8.960 -43.281 1.00 21.14 C ATOM 1330 C THR A 89 -7.518 8.883 -43.112 1.00 72.32 C ATOM 1331 O THR A 89 -6.986 9.264 -42.063 1.00 61.43 O ATOM 1332 CB THR A 89 -9.755 8.330 -42.050 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.523 9.124 -40.875 1.00 70.41 O ATOM 1334 CG2 THR A 89 -9.277 6.904 -41.798 1.00 23.35 C ATOM 0 H THR A 89 -9.888 7.394 -44.406 1.00 71.10 H new ATOM 0 HA THR A 89 -9.319 10.014 -43.346 1.00 21.14 H new ATOM 0 HB THR A 89 -10.823 8.303 -42.268 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.595 9.440 -40.872 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.792 6.496 -40.929 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.494 6.288 -42.671 1.00 23.35 H new ATOM 0 HG23 THR A 89 -8.203 6.908 -41.614 1.00 23.35 H new ATOM 1342 N MET A 90 -6.807 8.417 -44.142 1.00 23.21 N ATOM 1343 CA MET A 90 -5.342 8.317 -44.087 1.00 52.35 C ATOM 1344 C MET A 90 -4.701 9.242 -45.133 1.00 34.44 C ATOM 1345 O MET A 90 -5.406 9.990 -45.816 1.00 64.34 O ATOM 1346 CB MET A 90 -4.900 6.857 -44.294 1.00 2.44 C ATOM 1347 CG MET A 90 -4.890 6.392 -45.745 1.00 20.52 C ATOM 1348 SD MET A 90 -4.910 4.595 -45.898 1.00 33.02 S ATOM 1349 CE MET A 90 -3.660 4.147 -44.702 1.00 71.33 C ATOM 0 H MET A 90 -7.218 8.104 -45.022 1.00 23.21 H new ATOM 0 HA MET A 90 -5.004 8.639 -43.102 1.00 52.35 H new ATOM 0 HB2 MET A 90 -3.899 6.733 -43.881 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.563 6.207 -43.723 1.00 2.44 H new ATOM 0 HG2 MET A 90 -5.756 6.806 -46.261 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.004 6.785 -46.243 1.00 20.52 H new ATOM 0 HE1 MET A 90 -3.198 3.204 -44.995 1.00 71.33 H new ATOM 0 HE2 MET A 90 -2.900 4.927 -44.661 1.00 71.33 H new ATOM 0 HE3 MET A 90 -4.119 4.036 -43.720 1.00 71.33 H new ATOM 1359 N THR A 91 -3.372 9.204 -45.249 1.00 54.53 N ATOM 1360 CA THR A 91 -2.646 10.080 -46.178 1.00 60.53 C ATOM 1361 C THR A 91 -1.886 9.273 -47.240 1.00 4.54 C ATOM 1362 O THR A 91 -1.919 8.042 -47.239 1.00 62.15 O ATOM 1363 CB THR A 91 -1.668 11.013 -45.421 1.00 2.34 C ATOM 1364 OG1 THR A 91 -0.759 10.242 -44.623 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.420 11.998 -44.527 1.00 54.53 C ATOM 0 H THR A 91 -2.774 8.576 -44.712 1.00 54.53 H new ATOM 0 HA THR A 91 -3.392 10.693 -46.684 1.00 60.53 H new ATOM 0 HB THR A 91 -1.109 11.578 -46.166 1.00 2.34 H new ATOM 0 HG1 THR A 91 -0.619 10.689 -43.762 1.00 75.53 H new ATOM 0 HG21 THR A 91 -1.706 12.638 -44.010 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.082 12.612 -45.138 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.010 11.447 -43.795 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.211 9.979 -48.151 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.498 9.345 -49.262 1.00 25.41 C ATOM 1375 C LEU A 92 0.714 8.561 -48.755 1.00 32.24 C ATOM 1376 O LEU A 92 1.471 9.047 -47.912 1.00 31.23 O ATOM 1377 CB LEU A 92 -0.078 10.421 -50.284 1.00 14.43 C ATOM 1378 CG LEU A 92 0.405 9.917 -51.666 1.00 74.12 C ATOM 1379 CD1 LEU A 92 0.305 11.034 -52.706 1.00 1.01 C ATOM 1380 CD2 LEU A 92 1.843 9.391 -51.606 1.00 24.41 C ATOM 0 H LEU A 92 -1.144 10.997 -48.140 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.162 8.634 -49.753 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -0.925 11.089 -50.442 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.720 11.017 -49.842 1.00 14.43 H new ATOM 0 HG LEU A 92 -0.245 9.092 -51.958 1.00 74.12 H new ATOM 0 HD11 LEU A 92 0.648 10.664 -53.672 1.00 1.01 H new ATOM 0 HD12 LEU A 92 -0.731 11.361 -52.790 1.00 1.01 H new ATOM 0 HD13 LEU A 92 0.927 11.875 -52.398 1.00 1.01 H new ATOM 0 HD21 LEU A 92 2.146 9.046 -52.595 1.00 24.41 H new ATOM 0 HD22 LEU A 92 2.509 10.190 -51.280 1.00 24.41 H new ATOM 0 HD23 LEU A 92 1.898 8.562 -50.900 1.00 24.41 H new ATOM 1392 N GLY A 93 0.875 7.345 -49.279 1.00 34.21 N ATOM 1393 CA GLY A 93 1.994 6.495 -48.909 1.00 5.55 C ATOM 1394 C GLY A 93 1.858 5.945 -47.505 1.00 72.25 C ATOM 1395 O GLY A 93 2.851 5.573 -46.876 1.00 64.11 O ATOM 0 H GLY A 93 0.240 6.931 -49.962 1.00 34.21 H new ATOM 0 HA2 GLY A 93 2.068 5.668 -49.615 1.00 5.55 H new ATOM 0 HA3 GLY A 93 2.921 7.064 -48.986 1.00 5.55 H new ATOM 1399 N GLU A 94 0.625 5.877 -47.016 1.00 71.34 N ATOM 1400 CA GLU A 94 0.366 5.495 -45.632 1.00 13.03 C ATOM 1401 C GLU A 94 -0.343 4.139 -45.553 1.00 35.11 C ATOM 1402 O GLU A 94 -1.117 3.775 -46.446 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.464 6.596 -44.954 1.00 33.44 C ATOM 1404 CG GLU A 94 -0.655 6.421 -43.451 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.023 7.727 -42.763 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.207 8.123 -42.804 1.00 1.51 O ATOM 1407 OE2 GLU A 94 -0.120 8.383 -42.206 1.00 22.02 O ATOM 0 H GLU A 94 -0.214 6.082 -47.559 1.00 71.34 H new ATOM 0 HA GLU A 94 1.316 5.388 -45.108 1.00 13.03 H new ATOM 0 HB2 GLU A 94 0.017 7.557 -45.135 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.445 6.636 -45.428 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.437 5.684 -43.269 1.00 42.11 H new ATOM 0 HG3 GLU A 94 0.262 6.027 -43.013 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.064 3.403 -44.474 1.00 63.35 N ATOM 1415 CA LYS A 95 -0.655 2.089 -44.219 1.00 74.54 C ATOM 1416 C LYS A 95 -1.220 2.027 -42.798 1.00 2.34 C ATOM 1417 O LYS A 95 -0.501 2.274 -41.823 1.00 24.43 O ATOM 1418 CB LYS A 95 0.394 0.979 -44.405 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.021 -0.364 -43.795 1.00 64.33 C ATOM 1420 CD LYS A 95 1.058 -1.433 -43.951 1.00 65.41 C ATOM 1421 CE LYS A 95 1.167 -1.918 -45.389 1.00 1.24 C ATOM 1422 NZ LYS A 95 -0.096 -2.559 -45.851 1.00 21.52 N ATOM 0 H LYS A 95 0.584 3.706 -43.747 1.00 63.35 H new ATOM 0 HA LYS A 95 -1.464 1.935 -44.934 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.582 0.843 -45.470 1.00 62.30 H new ATOM 0 HB3 LYS A 95 1.333 1.299 -43.954 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -0.242 -0.226 -42.736 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -0.940 -0.707 -44.270 1.00 64.33 H new ATOM 0 HD2 LYS A 95 2.018 -1.030 -43.629 1.00 65.41 H new ATOM 0 HD3 LYS A 95 0.831 -2.276 -43.299 1.00 65.41 H new ATOM 0 HE2 LYS A 95 1.408 -1.077 -46.040 1.00 1.24 H new ATOM 0 HE3 LYS A 95 1.988 -2.630 -45.472 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 0.094 -3.545 -46.122 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 -0.796 -2.540 -45.082 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 -0.468 -2.040 -46.672 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.502 1.688 -42.693 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.178 1.562 -41.404 1.00 55.24 C ATOM 1438 C ALA A 96 -4.084 0.330 -41.395 1.00 22.35 C ATOM 1439 O ALA A 96 -4.716 0.012 -42.399 1.00 52.31 O ATOM 1440 CB ALA A 96 -3.989 2.820 -41.104 1.00 14.21 C ATOM 0 H ALA A 96 -3.100 1.493 -43.496 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.423 1.442 -40.627 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -4.487 2.711 -40.140 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.324 3.683 -41.073 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -4.736 2.966 -41.884 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.124 -0.365 -40.266 1.00 62.33 N ATOM 1447 CA LEU A 97 -4.983 -1.533 -40.099 1.00 4.54 C ATOM 1448 C LEU A 97 -6.315 -1.092 -39.507 1.00 23.15 C ATOM 1449 O LEU A 97 -6.340 -0.464 -38.451 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.281 -2.561 -39.188 1.00 62.35 C ATOM 1451 CG LEU A 97 -5.061 -3.857 -38.872 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -4.095 -5.008 -38.598 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -5.989 -3.663 -37.668 1.00 12.41 C ATOM 0 H LEU A 97 -3.566 -0.138 -39.443 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.171 -2.005 -41.063 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.335 -2.838 -39.654 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.040 -2.071 -38.245 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.670 -4.099 -39.743 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.661 -5.913 -38.377 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.470 -5.175 -39.475 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.463 -4.758 -37.746 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.525 -4.591 -37.469 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.398 -3.390 -36.794 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.705 -2.870 -37.884 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.415 -1.409 -40.185 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.743 -1.014 -39.722 1.00 22.33 C ATOM 1467 C PHE A 98 -9.690 -2.210 -39.720 1.00 65.01 C ATOM 1468 O PHE A 98 -9.723 -2.994 -40.672 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.300 0.120 -40.603 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.669 0.616 -40.189 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -10.940 0.936 -38.867 1.00 54.43 C ATOM 1472 CD2 PHE A 98 -11.678 0.771 -41.127 1.00 1.45 C ATOM 1473 CE1 PHE A 98 -12.187 1.399 -38.489 1.00 53.50 C ATOM 1474 CE2 PHE A 98 -12.928 1.231 -40.755 1.00 61.40 C ATOM 1475 CZ PHE A 98 -13.182 1.545 -39.436 1.00 43.13 C ATOM 0 H PHE A 98 -7.413 -1.938 -41.057 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.659 -0.647 -38.699 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.602 0.957 -40.582 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.349 -0.228 -41.635 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -10.166 0.822 -38.122 1.00 54.43 H new ATOM 0 HD2 PHE A 98 -11.485 0.529 -42.162 1.00 1.45 H new ATOM 0 HE1 PHE A 98 -12.382 1.646 -37.456 1.00 53.50 H new ATOM 0 HE2 PHE A 98 -13.705 1.344 -41.497 1.00 61.40 H new ATOM 0 HZ PHE A 98 -14.158 1.905 -39.144 1.00 43.13 H new ATOM 1485 N THR A 99 -10.441 -2.355 -38.637 1.00 0.52 N ATOM 1486 CA THR A 99 -11.431 -3.414 -38.521 1.00 41.40 C ATOM 1487 C THR A 99 -12.733 -2.986 -39.197 1.00 32.20 C ATOM 1488 O THR A 99 -13.397 -2.054 -38.743 1.00 23.33 O ATOM 1489 CB THR A 99 -11.696 -3.764 -37.038 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.459 -4.098 -36.394 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.672 -4.932 -36.902 1.00 45.34 C ATOM 0 H THR A 99 -10.381 -1.746 -37.821 1.00 0.52 H new ATOM 0 HA THR A 99 -11.042 -4.303 -39.017 1.00 41.40 H new ATOM 0 HB THR A 99 -12.143 -2.892 -36.562 1.00 71.14 H new ATOM 0 HG1 THR A 99 -10.628 -4.318 -35.454 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.834 -5.150 -35.846 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.621 -4.669 -37.368 1.00 45.34 H new ATOM 0 HG23 THR A 99 -12.257 -5.812 -37.394 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.077 -3.655 -40.295 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.269 -3.319 -41.065 1.00 55.40 C ATOM 1501 C ILE A 100 -15.504 -4.006 -40.474 1.00 14.24 C ATOM 1502 O ILE A 100 -15.625 -5.241 -40.533 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.115 -3.733 -42.552 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -12.886 -3.049 -43.173 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.376 -3.395 -43.349 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -12.973 -1.538 -43.207 1.00 2.12 C ATOM 0 H ILE A 100 -12.542 -4.438 -40.672 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.395 -2.238 -41.014 1.00 55.40 H new ATOM 0 HB ILE A 100 -13.971 -4.813 -42.591 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -11.999 -3.339 -42.610 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -12.753 -3.418 -44.190 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.241 -3.696 -44.388 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.228 -3.927 -42.925 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -15.559 -2.321 -43.303 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -12.068 -1.132 -43.659 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -13.840 -1.237 -43.795 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -13.074 -1.156 -42.191 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.427 -3.214 -39.876 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.678 -3.729 -39.308 1.00 42.13 C ATOM 1520 C PRO A 101 -18.579 -4.326 -40.385 1.00 14.34 C ATOM 1521 O PRO A 101 -18.666 -3.797 -41.497 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.336 -2.490 -38.666 1.00 51.24 C ATOM 1523 CG PRO A 101 -17.236 -1.489 -38.542 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.315 -1.755 -39.699 1.00 24.24 C ATOM 0 HA PRO A 101 -17.505 -4.534 -38.594 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.148 -2.109 -39.285 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.763 -2.730 -37.692 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -17.626 -0.472 -38.577 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -16.713 -1.597 -37.592 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.623 -1.214 -40.594 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.291 -1.451 -39.479 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.266 -5.409 -40.039 1.00 62.24 N ATOM 1533 CA TYR A 102 -20.086 -6.148 -40.996 1.00 42.32 C ATOM 1534 C TYR A 102 -21.100 -5.240 -41.696 1.00 55.45 C ATOM 1535 O TYR A 102 -21.325 -5.363 -42.897 1.00 63.25 O ATOM 1536 CB TYR A 102 -20.814 -7.302 -40.288 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.865 -6.868 -39.273 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -21.525 -6.607 -37.950 1.00 34.34 C ATOM 1539 CD2 TYR A 102 -23.197 -6.729 -39.645 1.00 52.43 C ATOM 1540 CE1 TYR A 102 -22.485 -6.229 -37.029 1.00 44.51 C ATOM 1541 CE2 TYR A 102 -24.159 -6.349 -38.733 1.00 11.43 C ATOM 1542 CZ TYR A 102 -23.799 -6.100 -37.428 1.00 3.53 C ATOM 1543 OH TYR A 102 -24.764 -5.725 -36.519 1.00 60.43 O ATOM 0 H TYR A 102 -19.272 -5.798 -39.096 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.420 -6.552 -41.759 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.293 -7.927 -41.041 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -20.075 -7.923 -39.782 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -20.496 -6.701 -37.637 1.00 34.34 H new ATOM 0 HD2 TYR A 102 -23.484 -6.922 -40.668 1.00 52.43 H new ATOM 0 HE1 TYR A 102 -22.207 -6.036 -36.003 1.00 44.51 H new ATOM 0 HE2 TYR A 102 -25.189 -6.247 -39.041 1.00 11.43 H new ATOM 0 HH TYR A 102 -24.344 -5.540 -35.653 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.684 -4.312 -40.940 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.761 -3.456 -41.445 1.00 73.14 C ATOM 1555 C GLN A 103 -22.249 -2.444 -42.474 1.00 73.11 C ATOM 1556 O GLN A 103 -23.037 -1.813 -43.185 1.00 64.20 O ATOM 1557 CB GLN A 103 -23.437 -2.725 -40.278 1.00 20.21 C ATOM 1558 CG GLN A 103 -22.526 -1.741 -39.552 1.00 52.32 C ATOM 1559 CD GLN A 103 -23.203 -1.093 -38.359 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -24.042 -1.702 -37.698 1.00 44.32 O ATOM 1561 NE2 GLN A 103 -22.856 0.153 -38.085 1.00 41.41 N ATOM 0 H GLN A 103 -21.429 -4.132 -39.969 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.488 -4.096 -41.946 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -24.308 -2.188 -40.654 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.802 -3.462 -39.563 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -21.628 -2.261 -39.218 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -22.205 -0.966 -40.248 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -22.156 0.625 -38.657 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -23.289 0.642 -37.302 1.00 41.41 H new ATOM 1570 N LEU A 104 -20.932 -2.288 -42.546 1.00 62.14 N ATOM 1571 CA LEU A 104 -20.310 -1.349 -43.478 1.00 32.30 C ATOM 1572 C LEU A 104 -19.645 -2.107 -44.622 1.00 63.52 C ATOM 1573 O LEU A 104 -18.823 -1.552 -45.361 1.00 31.32 O ATOM 1574 CB LEU A 104 -19.276 -0.482 -42.744 1.00 72.14 C ATOM 1575 CG LEU A 104 -19.830 0.377 -41.592 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -18.709 1.170 -40.920 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -20.929 1.317 -42.094 1.00 71.42 C ATOM 0 H LEU A 104 -20.269 -2.803 -41.967 1.00 62.14 H new ATOM 0 HA LEU A 104 -21.082 -0.700 -43.890 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.498 -1.133 -42.347 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -18.800 0.178 -43.470 1.00 72.14 H new ATOM 0 HG LEU A 104 -20.267 -0.293 -40.851 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -19.123 1.770 -40.109 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -17.966 0.481 -40.519 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -18.238 1.826 -41.652 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -21.305 1.914 -41.263 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -20.521 1.977 -42.859 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -21.744 0.730 -42.518 1.00 71.42 H new ATOM 1589 N ALA A 105 -20.022 -3.376 -44.769 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.437 -4.248 -45.777 1.00 15.02 C ATOM 1591 C ALA A 105 -20.396 -5.373 -46.155 1.00 14.10 C ATOM 1592 O ALA A 105 -21.494 -5.485 -45.606 1.00 75.53 O ATOM 1593 CB ALA A 105 -18.127 -4.834 -45.261 1.00 53.05 C ATOM 0 H ALA A 105 -20.737 -3.823 -44.195 1.00 62.01 H new ATOM 0 HA ALA A 105 -19.242 -3.653 -46.669 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -17.695 -5.485 -46.021 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.430 -4.026 -45.037 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.318 -5.410 -44.355 1.00 53.05 H new ATOM 1599 N TYR A 106 -19.962 -6.210 -47.093 1.00 54.43 N ATOM 1600 CA TYR A 106 -20.721 -7.388 -47.507 1.00 22.33 C ATOM 1601 C TYR A 106 -20.941 -8.333 -46.324 1.00 52.22 C ATOM 1602 O TYR A 106 -21.903 -9.101 -46.299 1.00 2.43 O ATOM 1603 CB TYR A 106 -19.978 -8.127 -48.630 1.00 62.33 C ATOM 1604 CG TYR A 106 -18.620 -8.671 -48.210 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -17.510 -7.835 -48.106 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -18.450 -10.020 -47.907 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -16.278 -8.326 -47.716 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -17.221 -10.516 -47.515 1.00 43.13 C ATOM 1609 CZ TYR A 106 -16.138 -9.667 -47.420 1.00 60.03 C ATOM 1610 OH TYR A 106 -14.913 -10.160 -47.030 1.00 3.12 O ATOM 0 H TYR A 106 -19.077 -6.092 -47.587 1.00 54.43 H new ATOM 0 HA TYR A 106 -21.692 -7.057 -47.875 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -20.597 -8.952 -48.982 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -19.843 -7.448 -49.472 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -17.614 -6.785 -48.334 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -19.294 -10.690 -47.980 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -15.428 -7.663 -47.643 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -17.109 -11.565 -47.284 1.00 43.13 H new ATOM 0 HH TYR A 106 -14.987 -11.122 -46.858 1.00 3.12 H new ATOM 1620 N GLY A 107 -20.041 -8.246 -45.339 1.00 75.14 N ATOM 1621 CA GLY A 107 -20.069 -9.136 -44.186 1.00 10.44 C ATOM 1622 C GLY A 107 -21.385 -9.102 -43.434 1.00 30.53 C ATOM 1623 O GLY A 107 -21.699 -10.028 -42.689 1.00 60.22 O ATOM 0 H GLY A 107 -19.283 -7.563 -45.322 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.875 -10.156 -44.518 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -19.262 -8.863 -43.505 1.00 10.44 H new ATOM 1627 N GLU A 108 -22.157 -8.036 -43.628 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.464 -7.904 -42.993 1.00 2.53 C ATOM 1629 C GLU A 108 -24.342 -9.101 -43.343 1.00 1.12 C ATOM 1630 O GLU A 108 -24.955 -9.719 -42.469 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.147 -6.610 -43.451 1.00 42.32 C ATOM 1632 CG GLU A 108 -25.531 -6.391 -42.846 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.210 -5.144 -43.382 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -26.625 -5.154 -44.560 1.00 64.21 O ATOM 1635 OE2 GLU A 108 -26.325 -4.148 -42.631 1.00 42.51 O ATOM 0 H GLU A 108 -21.898 -7.249 -44.222 1.00 42.23 H new ATOM 0 HA GLU A 108 -23.323 -7.869 -41.913 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -23.510 -5.764 -43.192 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -24.234 -6.622 -44.537 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -26.156 -7.259 -43.054 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.442 -6.315 -41.762 1.00 4.21 H new ATOM 1642 N ARG A 109 -24.371 -9.429 -44.628 1.00 41.24 N ATOM 1643 CA ARG A 109 -25.208 -10.507 -45.144 1.00 2.14 C ATOM 1644 C ARG A 109 -24.359 -11.719 -45.533 1.00 64.15 C ATOM 1645 O ARG A 109 -24.879 -12.825 -45.697 1.00 50.12 O ATOM 1646 CB ARG A 109 -26.020 -9.983 -46.340 1.00 42.44 C ATOM 1647 CG ARG A 109 -27.151 -9.028 -45.937 1.00 24.32 C ATOM 1648 CD ARG A 109 -27.429 -7.976 -47.007 1.00 60.10 C ATOM 1649 NE ARG A 109 -26.431 -6.897 -46.984 1.00 12.51 N ATOM 1650 CZ ARG A 109 -25.810 -6.411 -48.064 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -26.085 -6.894 -49.271 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -24.925 -5.428 -47.935 1.00 72.20 N ATOM 0 H ARG A 109 -23.816 -8.957 -45.342 1.00 41.24 H new ATOM 0 HA ARG A 109 -25.897 -10.837 -44.366 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -25.349 -9.469 -47.028 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -26.444 -10.829 -46.880 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -28.059 -9.602 -45.750 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -26.889 -8.532 -45.002 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -27.431 -8.448 -47.989 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -28.423 -7.555 -46.854 1.00 60.10 H new ATOM 0 HE ARG A 109 -26.195 -6.490 -46.079 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -26.773 -7.639 -49.377 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -25.608 -6.519 -50.091 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -24.720 -5.045 -47.012 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -24.451 -5.057 -48.759 1.00 72.20 H new ATOM 1666 N GLY A 110 -23.047 -11.503 -45.650 1.00 51.44 N ATOM 1667 CA GLY A 110 -22.119 -12.575 -45.986 1.00 74.31 C ATOM 1668 C GLY A 110 -22.415 -13.202 -47.337 1.00 44.44 C ATOM 1669 O GLY A 110 -23.249 -12.693 -48.089 1.00 52.23 O ATOM 0 H GLY A 110 -22.607 -10.593 -45.516 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -21.102 -12.183 -45.987 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -22.164 -13.344 -45.215 1.00 74.31 H new ATOM 1673 N TYR A 111 -21.726 -14.297 -47.650 1.00 14.34 N ATOM 1674 CA TYR A 111 -21.973 -15.049 -48.883 1.00 51.25 C ATOM 1675 C TYR A 111 -21.715 -16.549 -48.665 1.00 15.01 C ATOM 1676 O TYR A 111 -22.636 -17.355 -48.804 1.00 51.22 O ATOM 1677 CB TYR A 111 -21.136 -14.515 -50.068 1.00 51.01 C ATOM 1678 CG TYR A 111 -21.533 -13.129 -50.552 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -22.771 -12.909 -51.148 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -20.668 -12.045 -50.422 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -23.135 -11.655 -51.600 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -21.027 -10.788 -50.871 1.00 42.35 C ATOM 1683 CZ TYR A 111 -22.260 -10.598 -51.457 1.00 75.40 C ATOM 1684 OH TYR A 111 -22.617 -9.347 -51.916 1.00 34.13 O ATOM 0 H TYR A 111 -20.988 -14.687 -47.064 1.00 14.34 H new ATOM 0 HA TYR A 111 -23.022 -14.909 -49.142 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -20.086 -14.496 -49.774 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -21.222 -15.214 -50.900 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -23.460 -13.733 -51.259 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -19.701 -12.189 -49.963 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -24.099 -11.503 -52.063 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -20.344 -9.958 -50.763 1.00 42.35 H new ATOM 0 HH TYR A 111 -21.891 -8.714 -51.738 1.00 34.13 H new ATOM 1694 N PRO A 112 -20.473 -16.965 -48.309 1.00 71.14 N ATOM 1695 CA PRO A 112 -20.158 -18.373 -48.082 1.00 74.05 C ATOM 1696 C PRO A 112 -20.304 -18.765 -46.605 1.00 44.53 C ATOM 1697 O PRO A 112 -20.114 -17.932 -45.723 1.00 35.22 O ATOM 1698 CB PRO A 112 -18.695 -18.441 -48.523 1.00 3.14 C ATOM 1699 CG PRO A 112 -18.121 -17.120 -48.112 1.00 55.31 C ATOM 1700 CD PRO A 112 -19.267 -16.124 -48.107 1.00 34.32 C ATOM 0 HA PRO A 112 -20.821 -19.055 -48.614 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -18.173 -19.268 -48.042 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -18.611 -18.593 -49.599 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -17.664 -17.188 -47.125 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -17.340 -16.806 -48.804 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -19.315 -15.576 -47.166 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -19.158 -15.385 -48.901 1.00 34.32 H new ATOM 1708 N PRO A 113 -20.614 -20.044 -46.312 1.00 75.52 N ATOM 1709 CA PRO A 113 -20.769 -20.525 -44.927 1.00 14.13 C ATOM 1710 C PRO A 113 -19.503 -20.287 -44.098 1.00 51.33 C ATOM 1711 O PRO A 113 -19.543 -20.287 -42.865 1.00 50.55 O ATOM 1712 CB PRO A 113 -21.052 -22.032 -45.091 1.00 71.32 C ATOM 1713 CG PRO A 113 -20.606 -22.365 -46.477 1.00 43.15 C ATOM 1714 CD PRO A 113 -20.839 -21.120 -47.290 1.00 14.23 C ATOM 0 HA PRO A 113 -21.561 -20.000 -44.393 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -20.507 -22.618 -44.351 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -22.111 -22.251 -44.955 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -19.554 -22.651 -46.492 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -21.171 -23.206 -46.879 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -20.150 -21.052 -48.132 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -21.848 -21.088 -47.701 1.00 14.23 H new ATOM 1722 N VAL A 114 -18.380 -20.093 -44.791 1.00 63.42 N ATOM 1723 CA VAL A 114 -17.107 -19.781 -44.144 1.00 23.21 C ATOM 1724 C VAL A 114 -17.115 -18.344 -43.619 1.00 74.31 C ATOM 1725 O VAL A 114 -16.558 -18.052 -42.560 1.00 2.15 O ATOM 1726 CB VAL A 114 -15.919 -19.965 -45.124 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -14.584 -19.703 -44.423 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -15.944 -21.361 -45.750 1.00 53.14 C ATOM 0 H VAL A 114 -18.328 -20.147 -45.808 1.00 63.42 H new ATOM 0 HA VAL A 114 -16.981 -20.473 -43.311 1.00 23.21 H new ATOM 0 HB VAL A 114 -16.025 -19.233 -45.925 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -13.768 -19.839 -45.132 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -14.567 -18.682 -44.042 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -14.465 -20.401 -43.595 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -15.102 -21.468 -46.434 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -15.872 -22.113 -44.965 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -16.876 -21.497 -46.298 1.00 53.14 H new ATOM 1738 N ILE A 115 -17.764 -17.453 -44.367 1.00 51.04 N ATOM 1739 CA ILE A 115 -17.908 -16.053 -43.979 1.00 15.41 C ATOM 1740 C ILE A 115 -19.400 -15.724 -43.889 1.00 5.40 C ATOM 1741 O ILE A 115 -19.990 -15.191 -44.835 1.00 35.31 O ATOM 1742 CB ILE A 115 -17.206 -15.097 -44.985 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -15.716 -15.462 -45.132 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -17.362 -13.636 -44.556 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -14.916 -15.336 -43.848 1.00 54.20 C ATOM 0 H ILE A 115 -18.204 -17.682 -45.258 1.00 51.04 H new ATOM 0 HA ILE A 115 -17.427 -15.907 -43.012 1.00 15.41 H new ATOM 0 HB ILE A 115 -17.688 -15.217 -45.955 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -15.638 -16.486 -45.496 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -15.269 -14.819 -45.890 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -16.862 -12.990 -45.277 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -18.421 -13.380 -44.513 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -16.915 -13.496 -43.572 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -13.878 -15.611 -44.037 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -14.960 -14.307 -43.492 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -15.335 -16.000 -43.092 1.00 54.20 H new ATOM 1757 N PRO A 116 -20.037 -16.091 -42.762 1.00 1.54 N ATOM 1758 CA PRO A 116 -21.488 -15.971 -42.593 1.00 4.42 C ATOM 1759 C PRO A 116 -21.928 -14.524 -42.356 1.00 1.54 C ATOM 1760 O PRO A 116 -21.092 -13.645 -42.151 1.00 44.24 O ATOM 1761 CB PRO A 116 -21.757 -16.837 -41.353 1.00 0.11 C ATOM 1762 CG PRO A 116 -20.505 -16.735 -40.551 1.00 2.34 C ATOM 1763 CD PRO A 116 -19.383 -16.639 -41.553 1.00 73.41 C ATOM 0 HA PRO A 116 -22.040 -16.285 -43.479 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -22.618 -16.473 -40.793 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -21.970 -17.870 -41.628 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -20.526 -15.859 -39.902 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -20.381 -17.606 -39.907 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -18.585 -15.986 -41.199 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -18.935 -17.614 -41.747 1.00 73.41 H new ATOM 1771 N PRO A 117 -23.248 -14.257 -42.406 1.00 32.11 N ATOM 1772 CA PRO A 117 -23.801 -12.935 -42.093 1.00 23.42 C ATOM 1773 C PRO A 117 -23.280 -12.390 -40.761 1.00 61.41 C ATOM 1774 O PRO A 117 -22.990 -13.162 -39.841 1.00 22.34 O ATOM 1775 CB PRO A 117 -25.311 -13.192 -42.019 1.00 44.33 C ATOM 1776 CG PRO A 117 -25.536 -14.363 -42.918 1.00 52.33 C ATOM 1777 CD PRO A 117 -24.302 -15.217 -42.800 1.00 32.41 C ATOM 0 HA PRO A 117 -23.520 -12.186 -42.834 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -25.627 -13.409 -40.999 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -25.878 -12.322 -42.351 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -26.425 -14.919 -42.621 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -25.691 -14.041 -43.948 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -24.428 -16.002 -42.054 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -24.064 -15.709 -43.743 1.00 32.41 H new ATOM 1785 N LYS A 118 -23.170 -11.060 -40.677 1.00 12.23 N ATOM 1786 CA LYS A 118 -22.680 -10.370 -39.478 1.00 22.13 C ATOM 1787 C LYS A 118 -21.170 -10.568 -39.299 1.00 41.51 C ATOM 1788 O LYS A 118 -20.622 -10.311 -38.225 1.00 20.11 O ATOM 1789 CB LYS A 118 -23.445 -10.842 -38.227 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.947 -10.560 -38.281 1.00 0.22 C ATOM 1791 CD LYS A 118 -25.708 -11.304 -37.185 1.00 12.22 C ATOM 1792 CE LYS A 118 -25.558 -12.817 -37.330 1.00 54.44 C ATOM 1793 NZ LYS A 118 -26.360 -13.561 -36.324 1.00 73.32 N ATOM 0 H LYS A 118 -23.419 -10.430 -41.440 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.862 -9.303 -39.610 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -23.290 -11.913 -38.100 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -23.024 -10.353 -37.349 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -25.119 -9.489 -38.178 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -25.336 -10.853 -39.256 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -25.339 -10.992 -36.208 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -26.764 -11.036 -37.227 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -25.867 -13.116 -38.332 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -24.507 -13.088 -37.226 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -26.227 -14.583 -36.461 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -26.049 -13.296 -35.368 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -27.366 -13.325 -36.438 1.00 73.32 H new ATOM 1807 N ALA A 119 -20.497 -10.982 -40.371 1.00 25.12 N ATOM 1808 CA ALA A 119 -19.055 -11.212 -40.338 1.00 55.24 C ATOM 1809 C ALA A 119 -18.278 -9.898 -40.415 1.00 12.24 C ATOM 1810 O ALA A 119 -18.193 -9.271 -41.474 1.00 74.12 O ATOM 1811 CB ALA A 119 -18.630 -12.140 -41.471 1.00 71.50 C ATOM 0 H ALA A 119 -20.930 -11.165 -41.276 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.821 -11.689 -39.386 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -17.552 -12.298 -41.427 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -19.141 -13.097 -41.368 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -18.892 -11.689 -42.428 1.00 71.50 H new ATOM 1817 N THR A 120 -17.742 -9.476 -39.275 1.00 51.12 N ATOM 1818 CA THR A 120 -16.831 -8.339 -39.213 1.00 71.23 C ATOM 1819 C THR A 120 -15.413 -8.811 -39.546 1.00 20.24 C ATOM 1820 O THR A 120 -14.963 -9.840 -39.035 1.00 3.02 O ATOM 1821 CB THR A 120 -16.877 -7.686 -37.810 1.00 65.31 C ATOM 1822 OG1 THR A 120 -18.205 -7.201 -37.552 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.880 -6.538 -37.682 1.00 44.33 C ATOM 0 H THR A 120 -17.926 -9.911 -38.371 1.00 51.12 H new ATOM 0 HA THR A 120 -17.137 -7.588 -39.941 1.00 71.23 H new ATOM 0 HB THR A 120 -16.603 -8.446 -37.079 1.00 65.31 H new ATOM 0 HG1 THR A 120 -18.236 -6.789 -36.663 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.946 -6.109 -36.682 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.870 -6.913 -37.850 1.00 44.33 H new ATOM 0 HG23 THR A 120 -16.111 -5.772 -38.422 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.707 -8.068 -40.397 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.430 -8.544 -40.942 1.00 73.03 C ATOM 1833 C LEU A 121 -12.402 -7.410 -40.931 1.00 70.13 C ATOM 1834 O LEU A 121 -12.764 -6.246 -41.102 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.663 -9.091 -42.370 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.718 -10.219 -42.850 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.326 -9.693 -43.181 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.644 -11.340 -41.810 1.00 11.54 C ATOM 0 H LEU A 121 -14.991 -7.144 -40.723 1.00 2.41 H new ATOM 0 HA LEU A 121 -13.034 -9.350 -40.325 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.688 -9.458 -42.430 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.581 -8.259 -43.070 1.00 5.25 H new ATOM 0 HG LEU A 121 -13.136 -10.626 -43.771 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.695 -10.517 -43.514 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.397 -8.948 -43.973 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.889 -9.237 -42.293 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -11.975 -12.123 -42.166 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -12.266 -10.939 -40.870 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.639 -11.757 -41.653 1.00 11.54 H new ATOM 1850 N VAL A 122 -11.125 -7.742 -40.730 1.00 31.41 N ATOM 1851 CA VAL A 122 -10.081 -6.730 -40.615 1.00 43.23 C ATOM 1852 C VAL A 122 -9.353 -6.567 -41.947 1.00 70.11 C ATOM 1853 O VAL A 122 -9.056 -7.549 -42.626 1.00 44.44 O ATOM 1854 CB VAL A 122 -9.056 -7.099 -39.509 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.970 -6.032 -39.393 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.759 -7.306 -38.168 1.00 74.23 C ATOM 0 H VAL A 122 -10.793 -8.703 -40.644 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.561 -5.790 -40.343 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.577 -8.037 -39.791 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -7.265 -6.314 -38.611 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.443 -5.944 -40.343 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -8.426 -5.074 -39.142 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -9.022 -7.564 -37.407 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -10.272 -6.388 -37.881 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.485 -8.114 -38.259 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.085 -5.327 -42.327 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.361 -5.039 -43.558 1.00 14.15 C ATOM 1868 C PHE A 123 -7.319 -3.953 -43.320 1.00 24.01 C ATOM 1869 O PHE A 123 -7.622 -2.905 -42.740 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.325 -4.584 -44.669 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.240 -5.667 -45.195 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -9.853 -6.461 -46.268 1.00 52.10 C ATOM 1873 CD2 PHE A 123 -11.487 -5.886 -44.626 1.00 51.11 C ATOM 1874 CE1 PHE A 123 -10.690 -7.448 -46.757 1.00 34.12 C ATOM 1875 CE2 PHE A 123 -12.326 -6.869 -45.113 1.00 23.22 C ATOM 1876 CZ PHE A 123 -11.928 -7.651 -46.180 1.00 24.21 C ATOM 0 H PHE A 123 -9.359 -4.499 -41.798 1.00 33.02 H new ATOM 0 HA PHE A 123 -7.864 -5.956 -43.874 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -9.935 -3.765 -44.289 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -8.740 -4.187 -45.499 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -8.887 -6.306 -46.726 1.00 52.10 H new ATOM 0 HD2 PHE A 123 -11.805 -5.279 -43.791 1.00 51.11 H new ATOM 0 HE1 PHE A 123 -10.375 -8.060 -47.590 1.00 34.12 H new ATOM 0 HE2 PHE A 123 -13.293 -7.026 -44.660 1.00 23.22 H new ATOM 0 HZ PHE A 123 -12.584 -8.419 -46.562 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.088 -4.217 -43.737 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.081 -3.175 -43.812 1.00 51.31 C ATOM 1888 C GLU A 124 -5.371 -2.301 -45.022 1.00 24.30 C ATOM 1889 O GLU A 124 -5.380 -2.791 -46.158 1.00 64.22 O ATOM 1890 CB GLU A 124 -3.661 -3.755 -43.929 1.00 15.04 C ATOM 1891 CG GLU A 124 -3.061 -4.245 -42.614 1.00 23.21 C ATOM 1892 CD GLU A 124 -1.597 -4.652 -42.750 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -0.933 -4.217 -43.722 1.00 21.31 O ATOM 1894 OE2 GLU A 124 -1.103 -5.420 -41.896 1.00 32.21 O ATOM 0 H GLU A 124 -5.767 -5.141 -44.027 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.124 -2.591 -42.892 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -3.679 -4.585 -44.636 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -3.005 -2.993 -44.350 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -3.147 -3.458 -41.865 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -3.638 -5.095 -42.251 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.626 -1.025 -44.770 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.854 -0.061 -45.834 1.00 0.42 C ATOM 1903 C VAL A 125 -4.544 0.655 -46.138 1.00 41.00 C ATOM 1904 O VAL A 125 -3.786 1.001 -45.227 1.00 20.15 O ATOM 1905 CB VAL A 125 -6.961 0.972 -45.471 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.303 0.267 -45.265 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -6.583 1.785 -44.229 1.00 11.44 C ATOM 0 H VAL A 125 -5.680 -0.632 -43.830 1.00 22.33 H new ATOM 0 HA VAL A 125 -6.205 -0.601 -46.713 1.00 0.42 H new ATOM 0 HB VAL A 125 -7.055 1.667 -46.305 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.066 1.003 -45.012 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.587 -0.249 -46.182 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.214 -0.456 -44.454 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -7.378 2.496 -44.004 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -6.447 1.113 -43.382 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -5.655 2.325 -44.416 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.259 0.829 -47.417 1.00 43.13 N ATOM 1918 CA GLU A 126 -2.981 1.371 -47.856 1.00 63.02 C ATOM 1919 C GLU A 126 -3.205 2.358 -48.998 1.00 75.21 C ATOM 1920 O GLU A 126 -3.670 1.977 -50.069 1.00 73.13 O ATOM 1921 CB GLU A 126 -2.098 0.200 -48.305 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.630 0.536 -48.533 1.00 43.20 C ATOM 1923 CD GLU A 126 0.175 -0.687 -48.950 1.00 3.30 C ATOM 1924 OE1 GLU A 126 -0.081 -1.789 -48.403 1.00 32.43 O ATOM 1925 OE2 GLU A 126 1.042 -0.567 -49.837 1.00 33.31 O ATOM 0 H GLU A 126 -4.900 0.601 -48.177 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.489 1.907 -47.045 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -2.160 -0.588 -47.554 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.507 -0.207 -49.229 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.549 1.304 -49.303 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.207 0.954 -47.620 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.896 3.625 -48.762 1.00 44.31 N ATOM 1933 CA LEU A 127 -3.095 4.661 -49.776 1.00 71.21 C ATOM 1934 C LEU A 127 -1.777 4.915 -50.501 1.00 21.13 C ATOM 1935 O LEU A 127 -0.827 5.427 -49.912 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.634 5.952 -49.117 1.00 2.35 C ATOM 1937 CG LEU A 127 -4.233 7.023 -50.066 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -3.159 7.718 -50.896 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -5.291 6.410 -50.980 1.00 41.12 C ATOM 0 H LEU A 127 -2.508 3.964 -47.882 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.833 4.329 -50.506 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -4.401 5.671 -48.395 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.821 6.412 -48.555 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.704 7.777 -49.436 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.624 8.459 -51.546 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.449 8.211 -50.232 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.635 6.981 -51.504 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.696 7.181 -51.636 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.839 5.622 -51.582 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -6.094 5.989 -50.375 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.721 4.543 -51.779 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.500 4.689 -52.571 1.00 30.41 C ATOM 1953 C LEU A 128 -0.454 6.057 -53.240 1.00 2.23 C ATOM 1954 O LEU A 128 0.599 6.698 -53.285 1.00 15.42 O ATOM 1955 CB LEU A 128 -0.392 3.582 -53.635 1.00 73.21 C ATOM 1956 CG LEU A 128 -0.090 2.169 -53.102 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.204 2.159 -52.291 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -1.254 1.630 -52.274 1.00 51.52 C ATOM 0 H LEU A 128 -2.507 4.138 -52.288 1.00 14.43 H new ATOM 0 HA LEU A 128 0.347 4.598 -51.891 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -1.328 3.547 -54.193 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.390 3.858 -54.342 1.00 73.21 H new ATOM 0 HG LEU A 128 0.041 1.510 -53.961 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.396 1.150 -51.925 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.032 2.480 -52.923 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.109 2.840 -51.445 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -1.011 0.631 -51.912 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.433 2.290 -51.425 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -2.150 1.583 -52.893 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.595 6.505 -53.758 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.672 7.801 -54.429 1.00 1.24 C ATOM 1972 C ALA A 129 -3.077 8.383 -54.335 1.00 55.22 C ATOM 1973 O ALA A 129 -4.062 7.644 -54.349 1.00 1.51 O ATOM 1974 CB ALA A 129 -1.240 7.674 -55.887 1.00 14.11 C ATOM 0 H ALA A 129 -2.476 5.992 -53.727 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.990 8.485 -53.924 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -1.303 8.648 -56.371 1.00 14.11 H new ATOM 0 HB2 ALA A 129 -0.213 7.313 -55.932 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -1.895 6.970 -56.401 1.00 14.11 H new ATOM 1980 N VAL A 130 -3.158 9.707 -54.236 1.00 71.35 N ATOM 1981 CA VAL A 130 -4.435 10.409 -54.169 1.00 3.33 C ATOM 1982 C VAL A 130 -4.396 11.660 -55.060 1.00 10.44 C ATOM 1983 O VAL A 130 -3.969 12.741 -54.600 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.819 10.759 -52.695 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -3.664 11.445 -51.955 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -6.088 11.614 -52.648 1.00 32.12 C ATOM 1987 OXT VAL A 130 -4.757 11.547 -56.249 1.00 0.00 O ATOM 0 H VAL A 130 -2.344 10.321 -54.200 1.00 71.35 H new ATOM 0 HA VAL A 130 -5.214 9.747 -54.546 1.00 3.33 H new ATOM 0 HB VAL A 130 -5.023 9.821 -52.179 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -3.970 11.672 -50.934 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -2.799 10.782 -51.935 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -3.401 12.369 -52.469 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -6.334 11.844 -51.611 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -5.922 12.542 -53.196 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -6.913 11.066 -53.103 1.00 32.12 H new TER 1997 VAL A 130