USER MOD reduce.3.24.130724 H: found=0, std=0, add=416, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 415 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 912 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 916 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.55) USER MOD Single : A 917 THR OG1 : rot 180:sc= 0 USER MOD Single : A 921 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 923 HIS : no HD1:sc= -1.25 X(o=-1.3,f=-0.83) USER MOD Single : A 927 MET CE :methyl -162:sc= -0.0846 (180deg=-0.549) USER MOD Single : A 930 CYS SG : rot 180:sc= 0 USER MOD Single : A 933 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 935 ASN : amide:sc= -4.08 K(o=-4.1,f=-7.3!) USER MOD Single : A 940 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 941 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 942 HIS : no HE2:sc= -4.42! C(o=-4.4!,f=-7.3!) USER MOD Single : A 943 ASN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 944 TYR OH : rot 180:sc= 0 USER MOD Single : A 945 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 948 GLN : amide:sc=-0.00917 X(o=-0.0092,f=-0.0092) USER MOD Single : A 951 THR OG1 : rot 92:sc= 1.21 USER MOD Single : A 955 GLN : amide:sc= -0.0701 K(o=-0.07,f=-1.3!) USER MOD Single : A 957 ASN : amide:sc= -0.0131 X(o=-0.013,f=-0.19) USER MOD Single : A 958 ASN : amide:sc=-0.00672 K(o=-0.0067,f=-1.1) USER MOD Single : A 959 ASN : amide:sc= -0.353 K(o=-0.35,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 13.118 -0.236 -6.266 1.00 42.20 N ATOM 2 CA GLY A 908 12.490 1.057 -6.466 1.00 42.12 C ATOM 3 C GLY A 908 11.039 1.070 -6.030 1.00 14.41 C ATOM 4 O GLY A 908 10.492 0.060 -5.587 1.00 1.13 O ATOM 0 HA2 GLY A 908 13.040 1.815 -5.909 1.00 42.12 H new ATOM 0 HA3 GLY A 908 12.552 1.328 -7.520 1.00 42.12 H new ATOM 8 N PRO A 909 10.390 2.238 -6.152 1.00 45.34 N ATOM 9 CA PRO A 909 8.985 2.407 -5.771 1.00 41.54 C ATOM 10 C PRO A 909 8.037 1.671 -6.711 1.00 71.42 C ATOM 11 O PRO A 909 8.438 1.216 -7.783 1.00 41.15 O ATOM 12 CB PRO A 909 8.770 3.920 -5.872 1.00 72.42 C ATOM 13 CG PRO A 909 9.788 4.382 -6.856 1.00 42.51 C ATOM 14 CD PRO A 909 10.980 3.483 -6.673 1.00 15.51 C ATOM 0 HA PRO A 909 8.779 1.998 -4.782 1.00 41.54 H new ATOM 0 HB2 PRO A 909 7.760 4.155 -6.208 1.00 72.42 H new ATOM 0 HB3 PRO A 909 8.905 4.405 -4.905 1.00 72.42 H new ATOM 0 HG2 PRO A 909 9.404 4.318 -7.874 1.00 42.51 H new ATOM 0 HG3 PRO A 909 10.055 5.424 -6.681 1.00 42.51 H new ATOM 0 HD2 PRO A 909 11.506 3.316 -7.613 1.00 15.51 H new ATOM 0 HD3 PRO A 909 11.701 3.909 -5.976 1.00 15.51 H new ATOM 22 N LEU A 910 6.778 1.556 -6.303 1.00 71.13 N ATOM 23 CA LEU A 910 5.771 0.874 -7.110 1.00 5.12 C ATOM 24 C LEU A 910 5.459 1.667 -8.375 1.00 21.21 C ATOM 25 O LEU A 910 5.623 2.885 -8.412 1.00 53.55 O ATOM 26 CB LEU A 910 4.493 0.666 -6.296 1.00 60.41 C ATOM 27 CG LEU A 910 4.425 -0.619 -5.470 1.00 23.13 C ATOM 28 CD1 LEU A 910 4.491 -1.840 -6.374 1.00 41.24 C ATOM 29 CD2 LEU A 910 5.548 -0.653 -4.443 1.00 41.31 C ATOM 0 H LEU A 910 6.430 1.926 -5.419 1.00 71.13 H new ATOM 0 HA LEU A 910 6.171 -0.097 -7.402 1.00 5.12 H new ATOM 0 HB2 LEU A 910 4.373 1.514 -5.622 1.00 60.41 H new ATOM 0 HB3 LEU A 910 3.644 0.680 -6.980 1.00 60.41 H new ATOM 0 HG LEU A 910 3.473 -0.636 -4.940 1.00 23.13 H new ATOM 0 HD11 LEU A 910 4.441 -2.745 -5.768 1.00 41.24 H new ATOM 0 HD12 LEU A 910 3.652 -1.823 -7.070 1.00 41.24 H new ATOM 0 HD13 LEU A 910 5.427 -1.829 -6.933 1.00 41.24 H new ATOM 0 HD21 LEU A 910 5.484 -1.574 -3.864 1.00 41.31 H new ATOM 0 HD22 LEU A 910 6.510 -0.612 -4.954 1.00 41.31 H new ATOM 0 HD23 LEU A 910 5.455 0.203 -3.774 1.00 41.31 H new ATOM 41 N GLY A 911 5.006 0.966 -9.410 1.00 30.41 N ATOM 42 CA GLY A 911 4.676 1.621 -10.662 1.00 74.40 C ATOM 43 C GLY A 911 3.776 0.773 -11.540 1.00 1.21 C ATOM 44 O GLY A 911 2.561 0.971 -11.569 1.00 64.53 O ATOM 0 H GLY A 911 4.862 -0.044 -9.404 1.00 30.41 H new ATOM 0 HA2 GLY A 911 4.184 2.571 -10.453 1.00 74.40 H new ATOM 0 HA3 GLY A 911 5.595 1.850 -11.202 1.00 74.40 H new ATOM 48 N SER A 912 4.373 -0.172 -12.259 1.00 23.14 N ATOM 49 CA SER A 912 3.619 -1.049 -13.146 1.00 75.10 C ATOM 50 C SER A 912 2.880 -0.241 -14.209 1.00 20.31 C ATOM 51 O SER A 912 1.775 -0.597 -14.618 1.00 61.24 O ATOM 52 CB SER A 912 2.622 -1.888 -12.343 1.00 4.53 C ATOM 53 OG SER A 912 3.225 -2.414 -11.173 1.00 62.14 O ATOM 0 H SER A 912 5.377 -0.350 -12.244 1.00 23.14 H new ATOM 0 HA SER A 912 4.324 -1.714 -13.644 1.00 75.10 H new ATOM 0 HB2 SER A 912 1.763 -1.275 -12.069 1.00 4.53 H new ATOM 0 HB3 SER A 912 2.247 -2.704 -12.961 1.00 4.53 H new ATOM 0 HG SER A 912 2.568 -2.945 -10.676 1.00 62.14 H new ATOM 59 N SER A 913 3.499 0.849 -14.651 1.00 62.52 N ATOM 60 CA SER A 913 2.900 1.710 -15.664 1.00 1.23 C ATOM 61 C SER A 913 3.468 1.401 -17.046 1.00 31.45 C ATOM 62 O SER A 913 4.619 0.985 -17.176 1.00 13.10 O ATOM 63 CB SER A 913 3.141 3.181 -15.319 1.00 14.21 C ATOM 64 OG SER A 913 2.517 4.035 -16.263 1.00 22.23 O ATOM 0 H SER A 913 4.415 1.157 -14.324 1.00 62.52 H new ATOM 0 HA SER A 913 1.827 1.518 -15.680 1.00 1.23 H new ATOM 0 HB2 SER A 913 2.755 3.392 -14.322 1.00 14.21 H new ATOM 0 HB3 SER A 913 4.212 3.381 -15.295 1.00 14.21 H new ATOM 0 HG SER A 913 2.684 4.969 -16.019 1.00 22.23 H new ATOM 70 N GLU A 914 2.651 1.607 -18.074 1.00 31.52 N ATOM 71 CA GLU A 914 3.071 1.349 -19.446 1.00 62.41 C ATOM 72 C GLU A 914 4.080 2.395 -19.912 1.00 30.42 C ATOM 73 O GLU A 914 5.025 2.082 -20.636 1.00 22.41 O ATOM 74 CB GLU A 914 1.860 1.341 -20.381 1.00 31.50 C ATOM 75 CG GLU A 914 2.223 1.163 -21.846 1.00 32.23 C ATOM 76 CD GLU A 914 1.070 0.625 -22.671 1.00 40.22 C ATOM 77 OE1 GLU A 914 0.377 -0.297 -22.193 1.00 55.44 O ATOM 78 OE2 GLU A 914 0.862 1.127 -23.796 1.00 13.23 O ATOM 0 H GLU A 914 1.695 1.952 -17.983 1.00 31.52 H new ATOM 0 HA GLU A 914 3.549 0.370 -19.474 1.00 62.41 H new ATOM 0 HB2 GLU A 914 1.186 0.538 -20.082 1.00 31.50 H new ATOM 0 HB3 GLU A 914 1.313 2.277 -20.262 1.00 31.50 H new ATOM 0 HG2 GLU A 914 2.543 2.121 -22.256 1.00 32.23 H new ATOM 0 HG3 GLU A 914 3.071 0.483 -21.926 1.00 32.23 H new ATOM 85 N ASP A 915 3.871 3.637 -19.491 1.00 43.35 N ATOM 86 CA ASP A 915 4.762 4.730 -19.864 1.00 52.34 C ATOM 87 C ASP A 915 6.213 4.379 -19.554 1.00 24.41 C ATOM 88 O ASP A 915 7.125 4.769 -20.282 1.00 62.55 O ATOM 89 CB ASP A 915 4.366 6.012 -19.130 1.00 2.14 C ATOM 90 CG ASP A 915 5.113 7.227 -19.642 1.00 45.44 C ATOM 91 OD1 ASP A 915 5.775 7.116 -20.695 1.00 62.13 O ATOM 92 OD2 ASP A 915 5.037 8.290 -18.990 1.00 43.03 O ATOM 0 H ASP A 915 3.093 3.912 -18.892 1.00 43.35 H new ATOM 0 HA ASP A 915 4.668 4.892 -20.938 1.00 52.34 H new ATOM 0 HB2 ASP A 915 3.294 6.175 -19.242 1.00 2.14 H new ATOM 0 HB3 ASP A 915 4.561 5.892 -18.064 1.00 2.14 H new ATOM 97 N GLN A 916 6.419 3.641 -18.468 1.00 32.34 N ATOM 98 CA GLN A 916 7.760 3.239 -18.060 1.00 71.44 C ATOM 99 C GLN A 916 8.462 2.474 -19.178 1.00 32.12 C ATOM 100 O GLN A 916 9.645 2.688 -19.443 1.00 62.25 O ATOM 101 CB GLN A 916 7.695 2.376 -16.799 1.00 5.34 C ATOM 102 CG GLN A 916 9.048 2.163 -16.138 1.00 13.24 C ATOM 103 CD GLN A 916 9.621 3.441 -15.556 1.00 71.42 C ATOM 104 OE1 GLN A 916 10.227 4.243 -16.267 1.00 74.23 O ATOM 105 NE2 GLN A 916 9.432 3.637 -14.256 1.00 61.45 N ATOM 0 H GLN A 916 5.674 3.309 -17.855 1.00 32.34 H new ATOM 0 HA GLN A 916 8.333 4.141 -17.845 1.00 71.44 H new ATOM 0 HB2 GLN A 916 7.019 2.844 -16.083 1.00 5.34 H new ATOM 0 HB3 GLN A 916 7.268 1.406 -17.054 1.00 5.34 H new ATOM 0 HG2 GLN A 916 8.948 1.420 -15.346 1.00 13.24 H new ATOM 0 HG3 GLN A 916 9.746 1.757 -16.870 1.00 13.24 H new ATOM 0 HE21 GLN A 916 8.924 2.946 -13.705 1.00 61.45 H new ATOM 0 HE22 GLN A 916 9.795 4.479 -13.809 1.00 61.45 H new ATOM 114 N THR A 917 7.725 1.580 -19.830 1.00 52.34 N ATOM 115 CA THR A 917 8.277 0.782 -20.918 1.00 54.51 C ATOM 116 C THR A 917 8.884 1.670 -21.998 1.00 53.52 C ATOM 117 O THR A 917 9.984 1.410 -22.483 1.00 61.44 O ATOM 118 CB THR A 917 7.202 -0.119 -21.555 1.00 10.03 C ATOM 119 OG1 THR A 917 6.679 -1.024 -20.576 1.00 64.30 O ATOM 120 CG2 THR A 917 7.778 -0.904 -22.723 1.00 74.54 C ATOM 0 H THR A 917 6.744 1.390 -19.623 1.00 52.34 H new ATOM 0 HA THR A 917 9.057 0.155 -20.486 1.00 54.51 H new ATOM 0 HB THR A 917 6.399 0.517 -21.927 1.00 10.03 H new ATOM 0 HG1 THR A 917 5.995 -1.592 -20.988 1.00 64.30 H new ATOM 0 HG21 THR A 917 7.001 -1.533 -23.157 1.00 74.54 H new ATOM 0 HG22 THR A 917 8.149 -0.212 -23.479 1.00 74.54 H new ATOM 0 HG23 THR A 917 8.598 -1.531 -22.371 1.00 74.54 H new ATOM 128 N ALA A 918 8.160 2.721 -22.370 1.00 14.10 N ATOM 129 CA ALA A 918 8.629 3.649 -23.391 1.00 52.41 C ATOM 130 C ALA A 918 10.041 4.136 -23.083 1.00 51.15 C ATOM 131 O ALA A 918 10.814 4.441 -23.991 1.00 52.31 O ATOM 132 CB ALA A 918 7.676 4.830 -23.509 1.00 71.45 C ATOM 0 H ALA A 918 7.246 2.951 -21.979 1.00 14.10 H new ATOM 0 HA ALA A 918 8.654 3.120 -24.344 1.00 52.41 H new ATOM 0 HB1 ALA A 918 8.039 5.515 -24.275 1.00 71.45 H new ATOM 0 HB2 ALA A 918 6.684 4.471 -23.783 1.00 71.45 H new ATOM 0 HB3 ALA A 918 7.622 5.351 -22.553 1.00 71.45 H new ATOM 138 N ALA A 919 10.371 4.207 -21.798 1.00 34.40 N ATOM 139 CA ALA A 919 11.690 4.655 -21.371 1.00 42.13 C ATOM 140 C ALA A 919 12.727 3.550 -21.540 1.00 71.51 C ATOM 141 O ALA A 919 13.886 3.815 -21.859 1.00 45.15 O ATOM 142 CB ALA A 919 11.646 5.123 -19.924 1.00 42.53 C ATOM 0 H ALA A 919 9.742 3.960 -21.034 1.00 34.40 H new ATOM 0 HA ALA A 919 11.984 5.493 -22.004 1.00 42.13 H new ATOM 0 HB1 ALA A 919 12.638 5.455 -19.619 1.00 42.53 H new ATOM 0 HB2 ALA A 919 10.942 5.950 -19.830 1.00 42.53 H new ATOM 0 HB3 ALA A 919 11.326 4.300 -19.285 1.00 42.53 H new ATOM 148 N LEU A 920 12.303 2.309 -21.323 1.00 51.42 N ATOM 149 CA LEU A 920 13.195 1.162 -21.451 1.00 3.42 C ATOM 150 C LEU A 920 13.510 0.878 -22.916 1.00 24.02 C ATOM 151 O LEU A 920 14.674 0.752 -23.297 1.00 75.14 O ATOM 152 CB LEU A 920 12.566 -0.073 -20.803 1.00 42.45 C ATOM 153 CG LEU A 920 11.860 0.156 -19.467 1.00 1.43 C ATOM 154 CD1 LEU A 920 11.221 -1.132 -18.973 1.00 23.42 C ATOM 155 CD2 LEU A 920 12.837 0.700 -18.434 1.00 33.32 C ATOM 0 H LEU A 920 11.347 2.072 -21.058 1.00 51.42 H new ATOM 0 HA LEU A 920 14.127 1.399 -20.938 1.00 3.42 H new ATOM 0 HB2 LEU A 920 11.847 -0.499 -21.503 1.00 42.45 H new ATOM 0 HB3 LEU A 920 13.347 -0.819 -20.655 1.00 42.45 H new ATOM 0 HG LEU A 920 11.072 0.894 -19.616 1.00 1.43 H new ATOM 0 HD11 LEU A 920 10.723 -0.949 -18.021 1.00 23.42 H new ATOM 0 HD12 LEU A 920 10.490 -1.479 -19.704 1.00 23.42 H new ATOM 0 HD13 LEU A 920 11.991 -1.892 -18.840 1.00 23.42 H new ATOM 0 HD21 LEU A 920 12.317 0.857 -17.489 1.00 33.32 H new ATOM 0 HD22 LEU A 920 13.647 -0.014 -18.288 1.00 33.32 H new ATOM 0 HD23 LEU A 920 13.247 1.647 -18.784 1.00 33.32 H new ATOM 167 N MET A 921 12.466 0.780 -23.732 1.00 42.32 N ATOM 168 CA MET A 921 12.632 0.514 -25.156 1.00 44.34 C ATOM 169 C MET A 921 13.591 1.518 -25.789 1.00 25.05 C ATOM 170 O MET A 921 14.344 1.181 -26.702 1.00 24.44 O ATOM 171 CB MET A 921 11.279 0.567 -25.868 1.00 61.50 C ATOM 172 CG MET A 921 10.467 1.808 -25.538 1.00 54.24 C ATOM 173 SD MET A 921 9.554 2.439 -26.960 1.00 4.00 S ATOM 174 CE MET A 921 8.359 1.128 -27.204 1.00 61.44 C ATOM 0 H MET A 921 11.496 0.881 -23.432 1.00 42.32 H new ATOM 0 HA MET A 921 13.054 -0.485 -25.266 1.00 44.34 H new ATOM 0 HB2 MET A 921 11.443 0.526 -26.945 1.00 61.50 H new ATOM 0 HB3 MET A 921 10.701 -0.317 -25.599 1.00 61.50 H new ATOM 0 HG2 MET A 921 9.767 1.577 -24.735 1.00 54.24 H new ATOM 0 HG3 MET A 921 11.134 2.585 -25.165 1.00 54.24 H new ATOM 0 HE1 MET A 921 7.719 1.373 -28.051 1.00 61.44 H new ATOM 0 HE2 MET A 921 8.881 0.192 -27.402 1.00 61.44 H new ATOM 0 HE3 MET A 921 7.749 1.020 -26.307 1.00 61.44 H new ATOM 184 N ALA A 922 13.558 2.752 -25.297 1.00 1.21 N ATOM 185 CA ALA A 922 14.426 3.804 -25.813 1.00 34.21 C ATOM 186 C ALA A 922 15.878 3.560 -25.419 1.00 23.32 C ATOM 187 O ALA A 922 16.800 3.920 -26.152 1.00 71.51 O ATOM 188 CB ALA A 922 13.962 5.164 -25.312 1.00 21.43 C ATOM 0 H ALA A 922 12.940 3.048 -24.542 1.00 1.21 H new ATOM 0 HA ALA A 922 14.365 3.790 -26.901 1.00 34.21 H new ATOM 0 HB1 ALA A 922 14.619 5.940 -25.705 1.00 21.43 H new ATOM 0 HB2 ALA A 922 12.942 5.347 -25.649 1.00 21.43 H new ATOM 0 HB3 ALA A 922 13.992 5.180 -24.223 1.00 21.43 H new ATOM 194 N HIS A 923 16.076 2.947 -24.256 1.00 63.40 N ATOM 195 CA HIS A 923 17.418 2.655 -23.764 1.00 62.45 C ATOM 196 C HIS A 923 18.153 1.716 -24.716 1.00 60.53 C ATOM 197 O HIS A 923 19.370 1.809 -24.881 1.00 41.53 O ATOM 198 CB HIS A 923 17.349 2.034 -22.369 1.00 61.51 C ATOM 199 CG HIS A 923 16.775 2.950 -21.333 1.00 50.32 C ATOM 200 ND1 HIS A 923 16.727 4.320 -21.484 1.00 4.22 N ATOM 201 CD2 HIS A 923 16.220 2.686 -20.127 1.00 5.51 C ATOM 202 CE1 HIS A 923 16.170 4.859 -20.414 1.00 42.42 C ATOM 203 NE2 HIS A 923 15.853 3.889 -19.576 1.00 10.42 N ATOM 0 H HIS A 923 15.324 2.643 -23.637 1.00 63.40 H new ATOM 0 HA HIS A 923 17.970 3.593 -23.709 1.00 62.45 H new ATOM 0 HB2 HIS A 923 16.747 1.127 -22.414 1.00 61.51 H new ATOM 0 HB3 HIS A 923 18.352 1.736 -22.063 1.00 61.51 H new ATOM 0 HD2 HIS A 923 16.090 1.711 -19.681 1.00 5.51 H new ATOM 0 HE1 HIS A 923 16.002 5.914 -20.252 1.00 42.42 H new ATOM 0 HE2 HIS A 923 15.408 4.013 -18.667 1.00 10.42 H new ATOM 211 N LEU A 924 17.407 0.810 -25.340 1.00 11.24 N ATOM 212 CA LEU A 924 17.987 -0.147 -26.275 1.00 24.12 C ATOM 213 C LEU A 924 18.270 0.511 -27.622 1.00 23.43 C ATOM 214 O LEU A 924 19.337 0.319 -28.206 1.00 73.33 O ATOM 215 CB LEU A 924 17.048 -1.339 -26.464 1.00 31.32 C ATOM 216 CG LEU A 924 16.668 -2.102 -25.194 1.00 71.33 C ATOM 217 CD1 LEU A 924 15.181 -1.958 -24.910 1.00 0.24 C ATOM 218 CD2 LEU A 924 17.049 -3.570 -25.320 1.00 75.33 C ATOM 0 H LEU A 924 16.399 0.719 -25.215 1.00 11.24 H new ATOM 0 HA LEU A 924 18.931 -0.499 -25.858 1.00 24.12 H new ATOM 0 HB2 LEU A 924 16.133 -0.984 -26.938 1.00 31.32 H new ATOM 0 HB3 LEU A 924 17.515 -2.038 -27.158 1.00 31.32 H new ATOM 0 HG LEU A 924 17.220 -1.674 -24.357 1.00 71.33 H new ATOM 0 HD11 LEU A 924 14.929 -2.507 -24.003 1.00 0.24 H new ATOM 0 HD12 LEU A 924 14.937 -0.904 -24.776 1.00 0.24 H new ATOM 0 HD13 LEU A 924 14.610 -2.359 -25.747 1.00 0.24 H new ATOM 0 HD21 LEU A 924 16.771 -4.098 -24.407 1.00 75.33 H new ATOM 0 HD22 LEU A 924 16.524 -4.011 -26.168 1.00 75.33 H new ATOM 0 HD23 LEU A 924 18.125 -3.655 -25.475 1.00 75.33 H new ATOM 230 N PHE A 925 17.309 1.289 -28.108 1.00 71.50 N ATOM 231 CA PHE A 925 17.455 1.976 -29.386 1.00 12.13 C ATOM 232 C PHE A 925 18.700 2.858 -29.389 1.00 53.54 C ATOM 233 O PHE A 925 19.291 3.110 -30.439 1.00 24.54 O ATOM 234 CB PHE A 925 16.215 2.823 -29.678 1.00 14.44 C ATOM 235 CG PHE A 925 14.935 2.037 -29.664 1.00 51.24 C ATOM 236 CD1 PHE A 925 14.899 0.739 -30.146 1.00 62.44 C ATOM 237 CD2 PHE A 925 13.768 2.596 -29.170 1.00 12.44 C ATOM 238 CE1 PHE A 925 13.723 0.013 -30.136 1.00 53.41 C ATOM 239 CE2 PHE A 925 12.588 1.876 -29.156 1.00 63.24 C ATOM 240 CZ PHE A 925 12.566 0.582 -29.639 1.00 42.24 C ATOM 0 H PHE A 925 16.421 1.460 -27.636 1.00 71.50 H new ATOM 0 HA PHE A 925 17.563 1.222 -30.166 1.00 12.13 H new ATOM 0 HB2 PHE A 925 16.149 3.623 -28.940 1.00 14.44 H new ATOM 0 HB3 PHE A 925 16.330 3.297 -30.653 1.00 14.44 H new ATOM 0 HD1 PHE A 925 15.801 0.289 -30.534 1.00 62.44 H new ATOM 0 HD2 PHE A 925 13.780 3.607 -28.791 1.00 12.44 H new ATOM 0 HE1 PHE A 925 13.708 -0.998 -30.516 1.00 53.41 H new ATOM 0 HE2 PHE A 925 11.685 2.324 -28.768 1.00 63.24 H new ATOM 0 HZ PHE A 925 11.646 0.016 -29.628 1.00 42.24 H new ATOM 250 N GLU A 926 19.090 3.326 -28.208 1.00 20.13 N ATOM 251 CA GLU A 926 20.263 4.181 -28.075 1.00 44.41 C ATOM 252 C GLU A 926 21.536 3.418 -28.431 1.00 41.45 C ATOM 253 O GLU A 926 22.567 4.018 -28.735 1.00 22.25 O ATOM 254 CB GLU A 926 20.365 4.727 -26.649 1.00 45.54 C ATOM 255 CG GLU A 926 19.398 5.864 -26.362 1.00 62.50 C ATOM 256 CD GLU A 926 19.711 7.113 -27.163 1.00 22.34 C ATOM 257 OE1 GLU A 926 20.873 7.266 -27.594 1.00 52.11 O ATOM 258 OE2 GLU A 926 18.793 7.937 -27.358 1.00 4.04 O ATOM 0 H GLU A 926 18.611 3.127 -27.330 1.00 20.13 H new ATOM 0 HA GLU A 926 20.153 5.015 -28.769 1.00 44.41 H new ATOM 0 HB2 GLU A 926 20.179 3.916 -25.944 1.00 45.54 H new ATOM 0 HB3 GLU A 926 21.383 5.074 -26.474 1.00 45.54 H new ATOM 0 HG2 GLU A 926 18.383 5.538 -26.587 1.00 62.50 H new ATOM 0 HG3 GLU A 926 19.428 6.102 -25.299 1.00 62.50 H new ATOM 265 N MET A 927 21.455 2.093 -28.392 1.00 33.51 N ATOM 266 CA MET A 927 22.599 1.247 -28.711 1.00 43.12 C ATOM 267 C MET A 927 22.666 0.965 -30.209 1.00 35.43 C ATOM 268 O MET A 927 23.745 0.934 -30.797 1.00 44.53 O ATOM 269 CB MET A 927 22.521 -0.069 -27.935 1.00 13.10 C ATOM 270 CG MET A 927 22.422 0.118 -26.430 1.00 2.43 C ATOM 271 SD MET A 927 24.037 0.240 -25.638 1.00 5.03 S ATOM 272 CE MET A 927 23.744 -0.678 -24.128 1.00 64.10 C ATOM 0 H MET A 927 20.609 1.581 -28.143 1.00 33.51 H new ATOM 0 HA MET A 927 23.504 1.779 -28.418 1.00 43.12 H new ATOM 0 HB2 MET A 927 21.655 -0.634 -28.280 1.00 13.10 H new ATOM 0 HB3 MET A 927 23.403 -0.668 -28.161 1.00 13.10 H new ATOM 0 HG2 MET A 927 21.848 1.020 -26.217 1.00 2.43 H new ATOM 0 HG3 MET A 927 21.873 -0.719 -25.999 1.00 2.43 H new ATOM 0 HE1 MET A 927 24.515 -0.433 -23.398 1.00 64.10 H new ATOM 0 HE2 MET A 927 22.766 -0.414 -23.725 1.00 64.10 H new ATOM 0 HE3 MET A 927 23.772 -1.747 -24.341 1.00 64.10 H new ATOM 282 N GLY A 928 21.503 0.757 -30.820 1.00 12.54 N ATOM 283 CA GLY A 928 21.452 0.480 -32.243 1.00 72.40 C ATOM 284 C GLY A 928 20.702 -0.799 -32.558 1.00 34.44 C ATOM 285 O GLY A 928 20.676 -1.247 -33.704 1.00 42.13 O ATOM 0 H GLY A 928 20.596 0.776 -30.354 1.00 12.54 H new ATOM 0 HA2 GLY A 928 20.973 1.314 -32.755 1.00 72.40 H new ATOM 0 HA3 GLY A 928 22.467 0.407 -32.633 1.00 72.40 H new ATOM 289 N PHE A 929 20.090 -1.391 -31.537 1.00 11.01 N ATOM 290 CA PHE A 929 19.338 -2.628 -31.710 1.00 35.25 C ATOM 291 C PHE A 929 18.251 -2.461 -32.767 1.00 54.32 C ATOM 292 O PHE A 929 18.248 -3.154 -33.785 1.00 41.23 O ATOM 293 CB PHE A 929 18.711 -3.058 -30.382 1.00 32.44 C ATOM 294 CG PHE A 929 19.714 -3.545 -29.375 1.00 51.20 C ATOM 295 CD1 PHE A 929 20.460 -4.687 -29.617 1.00 33.12 C ATOM 296 CD2 PHE A 929 19.911 -2.860 -28.187 1.00 15.13 C ATOM 297 CE1 PHE A 929 21.384 -5.137 -28.693 1.00 30.32 C ATOM 298 CE2 PHE A 929 20.833 -3.305 -27.259 1.00 45.02 C ATOM 299 CZ PHE A 929 21.570 -4.446 -27.512 1.00 2.30 C ATOM 0 H PHE A 929 20.100 -1.034 -30.582 1.00 11.01 H new ATOM 0 HA PHE A 929 20.030 -3.400 -32.045 1.00 35.25 H new ATOM 0 HB2 PHE A 929 18.163 -2.216 -29.959 1.00 32.44 H new ATOM 0 HB3 PHE A 929 17.985 -3.849 -30.571 1.00 32.44 H new ATOM 0 HD1 PHE A 929 20.318 -5.232 -30.539 1.00 33.12 H new ATOM 0 HD2 PHE A 929 19.337 -1.968 -27.984 1.00 15.13 H new ATOM 0 HE1 PHE A 929 21.960 -6.028 -28.894 1.00 30.32 H new ATOM 0 HE2 PHE A 929 20.977 -2.762 -26.337 1.00 45.02 H new ATOM 0 HZ PHE A 929 22.290 -4.797 -26.788 1.00 2.30 H new ATOM 309 N CYS A 930 17.329 -1.537 -32.518 1.00 72.33 N ATOM 310 CA CYS A 930 16.235 -1.279 -33.448 1.00 11.21 C ATOM 311 C CYS A 930 15.337 -2.504 -33.585 1.00 12.12 C ATOM 312 O CYS A 930 15.099 -2.992 -34.690 1.00 43.51 O ATOM 313 CB CYS A 930 16.786 -0.879 -34.818 1.00 35.34 C ATOM 314 SG CYS A 930 15.685 0.192 -35.772 1.00 2.33 S ATOM 0 H CYS A 930 17.317 -0.955 -31.681 1.00 72.33 H new ATOM 0 HA CYS A 930 15.639 -0.457 -33.050 1.00 11.21 H new ATOM 0 HB2 CYS A 930 17.740 -0.370 -34.680 1.00 35.34 H new ATOM 0 HB3 CYS A 930 16.987 -1.782 -35.395 1.00 35.34 H new ATOM 0 HG CYS A 930 16.239 0.477 -36.913 1.00 2.33 H new ATOM 320 N ASP A 931 14.842 -2.997 -32.455 1.00 60.31 N ATOM 321 CA ASP A 931 13.970 -4.166 -32.448 1.00 64.54 C ATOM 322 C ASP A 931 12.885 -4.029 -31.385 1.00 60.12 C ATOM 323 O ASP A 931 12.985 -4.608 -30.304 1.00 20.44 O ATOM 324 CB ASP A 931 14.786 -5.436 -32.201 1.00 24.12 C ATOM 325 CG ASP A 931 15.905 -5.611 -33.209 1.00 20.20 C ATOM 326 OD1 ASP A 931 15.601 -5.858 -34.395 1.00 2.33 O ATOM 327 OD2 ASP A 931 17.084 -5.503 -32.812 1.00 44.31 O ATOM 0 H ASP A 931 15.030 -2.605 -31.532 1.00 60.31 H new ATOM 0 HA ASP A 931 13.490 -4.236 -33.424 1.00 64.54 H new ATOM 0 HB2 ASP A 931 15.208 -5.404 -31.196 1.00 24.12 H new ATOM 0 HB3 ASP A 931 14.126 -6.302 -32.242 1.00 24.12 H new ATOM 332 N ARG A 932 11.849 -3.258 -31.700 1.00 45.13 N ATOM 333 CA ARG A 932 10.747 -3.043 -30.771 1.00 53.53 C ATOM 334 C ARG A 932 10.086 -4.366 -30.396 1.00 13.41 C ATOM 335 O ARG A 932 9.529 -4.505 -29.307 1.00 55.55 O ATOM 336 CB ARG A 932 9.711 -2.099 -31.386 1.00 21.03 C ATOM 337 CG ARG A 932 8.900 -2.731 -32.506 1.00 4.44 C ATOM 338 CD ARG A 932 7.573 -3.271 -31.996 1.00 64.03 C ATOM 339 NE ARG A 932 6.518 -2.263 -32.042 1.00 50.40 N ATOM 340 CZ ARG A 932 5.896 -1.900 -33.158 1.00 43.44 C ATOM 341 NH1 ARG A 932 6.222 -2.460 -34.315 1.00 4.10 N ATOM 342 NH2 ARG A 932 4.946 -0.975 -33.119 1.00 51.52 N ATOM 0 H ARG A 932 11.750 -2.772 -32.591 1.00 45.13 H new ATOM 0 HA ARG A 932 11.151 -2.589 -29.866 1.00 53.53 H new ATOM 0 HB2 ARG A 932 9.032 -1.760 -30.604 1.00 21.03 H new ATOM 0 HB3 ARG A 932 10.220 -1.216 -31.771 1.00 21.03 H new ATOM 0 HG2 ARG A 932 8.718 -1.992 -33.286 1.00 4.44 H new ATOM 0 HG3 ARG A 932 9.473 -3.540 -32.960 1.00 4.44 H new ATOM 0 HD2 ARG A 932 7.278 -4.132 -32.595 1.00 64.03 H new ATOM 0 HD3 ARG A 932 7.694 -3.622 -30.971 1.00 64.03 H new ATOM 0 HE ARG A 932 6.243 -1.813 -31.169 1.00 50.40 H new ATOM 0 HH11 ARG A 932 6.952 -3.171 -34.349 1.00 4.10 H new ATOM 0 HH12 ARG A 932 5.743 -2.179 -35.170 1.00 4.10 H new ATOM 0 HH21 ARG A 932 4.692 -0.542 -32.231 1.00 51.52 H new ATOM 0 HH22 ARG A 932 4.469 -0.697 -33.977 1.00 51.52 H new ATOM 356 N GLN A 933 10.152 -5.333 -31.305 1.00 20.12 N ATOM 357 CA GLN A 933 9.559 -6.644 -31.069 1.00 32.11 C ATOM 358 C GLN A 933 10.363 -7.428 -30.037 1.00 42.12 C ATOM 359 O GLN A 933 9.799 -8.049 -29.136 1.00 33.13 O ATOM 360 CB GLN A 933 9.478 -7.433 -32.377 1.00 32.33 C ATOM 361 CG GLN A 933 8.538 -6.819 -33.401 1.00 54.30 C ATOM 362 CD GLN A 933 7.465 -7.786 -33.863 1.00 45.33 C ATOM 363 OE1 GLN A 933 6.806 -8.434 -33.051 1.00 30.35 O ATOM 364 NE2 GLN A 933 7.285 -7.887 -35.175 1.00 23.40 N ATOM 0 H GLN A 933 10.610 -5.234 -32.211 1.00 20.12 H new ATOM 0 HA GLN A 933 8.552 -6.495 -30.680 1.00 32.11 H new ATOM 0 HB2 GLN A 933 10.476 -7.506 -32.810 1.00 32.33 H new ATOM 0 HB3 GLN A 933 9.150 -8.449 -32.159 1.00 32.33 H new ATOM 0 HG2 GLN A 933 8.065 -5.936 -32.971 1.00 54.30 H new ATOM 0 HG3 GLN A 933 9.115 -6.484 -34.263 1.00 54.30 H new ATOM 0 HE21 GLN A 933 7.854 -7.330 -35.812 1.00 23.40 H new ATOM 0 HE22 GLN A 933 6.577 -8.521 -35.545 1.00 23.40 H new ATOM 373 N LEU A 934 11.684 -7.395 -30.175 1.00 60.42 N ATOM 374 CA LEU A 934 12.567 -8.103 -29.255 1.00 21.41 C ATOM 375 C LEU A 934 12.467 -7.522 -27.848 1.00 74.22 C ATOM 376 O LEU A 934 12.237 -8.247 -26.881 1.00 72.45 O ATOM 377 CB LEU A 934 14.014 -8.030 -29.747 1.00 74.21 C ATOM 378 CG LEU A 934 14.524 -9.251 -30.514 1.00 3.25 C ATOM 379 CD1 LEU A 934 13.554 -9.629 -31.622 1.00 64.30 C ATOM 380 CD2 LEU A 934 15.910 -8.982 -31.083 1.00 55.42 C ATOM 0 H LEU A 934 12.167 -6.886 -30.915 1.00 60.42 H new ATOM 0 HA LEU A 934 12.253 -9.146 -29.221 1.00 21.41 H new ATOM 0 HB2 LEU A 934 14.115 -7.155 -30.389 1.00 74.21 H new ATOM 0 HB3 LEU A 934 14.662 -7.870 -28.885 1.00 74.21 H new ATOM 0 HG LEU A 934 14.594 -10.089 -29.821 1.00 3.25 H new ATOM 0 HD11 LEU A 934 13.934 -10.500 -32.157 1.00 64.30 H new ATOM 0 HD12 LEU A 934 12.582 -9.864 -31.190 1.00 64.30 H new ATOM 0 HD13 LEU A 934 13.450 -8.794 -32.315 1.00 64.30 H new ATOM 0 HD21 LEU A 934 16.258 -9.861 -31.626 1.00 55.42 H new ATOM 0 HD22 LEU A 934 15.866 -8.131 -31.762 1.00 55.42 H new ATOM 0 HD23 LEU A 934 16.601 -8.761 -30.269 1.00 55.42 H new ATOM 392 N ASN A 935 12.638 -6.208 -27.743 1.00 24.54 N ATOM 393 CA ASN A 935 12.565 -5.529 -26.454 1.00 64.21 C ATOM 394 C ASN A 935 11.252 -5.846 -25.746 1.00 32.22 C ATOM 395 O ASN A 935 11.181 -5.848 -24.516 1.00 45.20 O ATOM 396 CB ASN A 935 12.704 -4.017 -26.643 1.00 22.24 C ATOM 397 CG ASN A 935 13.743 -3.658 -27.687 1.00 50.33 C ATOM 398 OD1 ASN A 935 14.790 -4.298 -27.784 1.00 31.23 O ATOM 399 ND2 ASN A 935 13.457 -2.628 -28.476 1.00 22.12 N ATOM 0 H ASN A 935 12.828 -5.593 -28.534 1.00 24.54 H new ATOM 0 HA ASN A 935 13.387 -5.888 -25.834 1.00 64.21 H new ATOM 0 HB2 ASN A 935 11.740 -3.600 -26.935 1.00 22.24 H new ATOM 0 HB3 ASN A 935 12.975 -3.558 -25.692 1.00 22.24 H new ATOM 0 HD21 ASN A 935 14.118 -2.339 -29.198 1.00 22.12 H new ATOM 0 HD22 ASN A 935 12.577 -2.126 -28.360 1.00 22.12 H new ATOM 406 N LEU A 936 10.213 -6.115 -26.529 1.00 44.15 N ATOM 407 CA LEU A 936 8.901 -6.434 -25.978 1.00 62.51 C ATOM 408 C LEU A 936 8.881 -7.847 -25.403 1.00 63.35 C ATOM 409 O LEU A 936 8.481 -8.057 -24.258 1.00 51.33 O ATOM 410 CB LEU A 936 7.825 -6.295 -27.057 1.00 23.15 C ATOM 411 CG LEU A 936 6.418 -5.961 -26.561 1.00 51.52 C ATOM 412 CD1 LEU A 936 5.887 -7.073 -25.670 1.00 41.31 C ATOM 413 CD2 LEU A 936 6.416 -4.632 -25.818 1.00 74.43 C ATOM 0 H LEU A 936 10.254 -6.118 -27.548 1.00 44.15 H new ATOM 0 HA LEU A 936 8.692 -5.730 -25.172 1.00 62.51 H new ATOM 0 HB2 LEU A 936 8.137 -5.518 -27.755 1.00 23.15 H new ATOM 0 HB3 LEU A 936 7.779 -7.228 -27.619 1.00 23.15 H new ATOM 0 HG LEU A 936 5.760 -5.872 -27.426 1.00 51.52 H new ATOM 0 HD11 LEU A 936 4.885 -6.817 -25.327 1.00 41.31 H new ATOM 0 HD12 LEU A 936 5.850 -8.005 -26.234 1.00 41.31 H new ATOM 0 HD13 LEU A 936 6.545 -7.195 -24.810 1.00 41.31 H new ATOM 0 HD21 LEU A 936 5.406 -4.410 -25.472 1.00 74.43 H new ATOM 0 HD22 LEU A 936 7.088 -4.693 -24.962 1.00 74.43 H new ATOM 0 HD23 LEU A 936 6.752 -3.840 -26.488 1.00 74.43 H new ATOM 425 N ARG A 937 9.318 -8.813 -26.205 1.00 40.15 N ATOM 426 CA ARG A 937 9.351 -10.206 -25.776 1.00 44.23 C ATOM 427 C ARG A 937 10.395 -10.413 -24.682 1.00 52.24 C ATOM 428 O ARG A 937 10.258 -11.300 -23.838 1.00 53.54 O ATOM 429 CB ARG A 937 9.654 -11.121 -26.964 1.00 41.45 C ATOM 430 CG ARG A 937 11.137 -11.247 -27.274 1.00 11.43 C ATOM 431 CD ARG A 937 11.741 -12.476 -26.613 1.00 43.21 C ATOM 432 NE ARG A 937 11.091 -13.708 -27.051 1.00 64.03 N ATOM 433 CZ ARG A 937 11.350 -14.901 -26.528 1.00 63.45 C ATOM 434 NH1 ARG A 937 12.240 -15.023 -25.553 1.00 45.24 N ATOM 435 NH2 ARG A 937 10.718 -15.977 -26.981 1.00 14.43 N ATOM 0 H ARG A 937 9.654 -8.656 -27.155 1.00 40.15 H new ATOM 0 HA ARG A 937 8.371 -10.459 -25.372 1.00 44.23 H new ATOM 0 HB2 ARG A 937 9.249 -12.112 -26.761 1.00 41.45 H new ATOM 0 HB3 ARG A 937 9.138 -10.740 -27.846 1.00 41.45 H new ATOM 0 HG2 ARG A 937 11.281 -11.305 -28.353 1.00 11.43 H new ATOM 0 HG3 ARG A 937 11.659 -10.354 -26.930 1.00 11.43 H new ATOM 0 HD2 ARG A 937 12.805 -12.526 -26.844 1.00 43.21 H new ATOM 0 HD3 ARG A 937 11.654 -12.385 -25.530 1.00 43.21 H new ATOM 0 HE ARG A 937 10.400 -13.649 -27.799 1.00 64.03 H new ATOM 0 HH11 ARG A 937 12.728 -14.199 -25.202 1.00 45.24 H new ATOM 0 HH12 ARG A 937 12.436 -15.941 -25.154 1.00 45.24 H new ATOM 0 HH21 ARG A 937 10.033 -15.888 -27.731 1.00 14.43 H new ATOM 0 HH22 ARG A 937 10.918 -16.893 -26.579 1.00 14.43 H new ATOM 449 N LEU A 938 11.437 -9.590 -24.703 1.00 44.13 N ATOM 450 CA LEU A 938 12.505 -9.682 -23.714 1.00 22.44 C ATOM 451 C LEU A 938 12.036 -9.166 -22.357 1.00 25.20 C ATOM 452 O LEU A 938 12.231 -9.819 -21.331 1.00 21.40 O ATOM 453 CB LEU A 938 13.728 -8.890 -24.179 1.00 24.44 C ATOM 454 CG LEU A 938 14.897 -9.716 -24.717 1.00 43.15 C ATOM 455 CD1 LEU A 938 15.355 -10.732 -23.683 1.00 4.35 C ATOM 456 CD2 LEU A 938 14.507 -10.411 -26.013 1.00 75.24 C ATOM 0 H LEU A 938 11.565 -8.851 -25.394 1.00 44.13 H new ATOM 0 HA LEU A 938 12.779 -10.732 -23.608 1.00 22.44 H new ATOM 0 HB2 LEU A 938 13.412 -8.195 -24.957 1.00 24.44 H new ATOM 0 HB3 LEU A 938 14.087 -8.290 -23.343 1.00 24.44 H new ATOM 0 HG LEU A 938 15.727 -9.041 -24.925 1.00 43.15 H new ATOM 0 HD11 LEU A 938 16.187 -11.310 -24.085 1.00 4.35 H new ATOM 0 HD12 LEU A 938 15.676 -10.213 -22.780 1.00 4.35 H new ATOM 0 HD13 LEU A 938 14.530 -11.403 -23.442 1.00 4.35 H new ATOM 0 HD21 LEU A 938 15.351 -10.994 -26.381 1.00 75.24 H new ATOM 0 HD22 LEU A 938 13.661 -11.073 -25.830 1.00 75.24 H new ATOM 0 HD23 LEU A 938 14.230 -9.664 -26.757 1.00 75.24 H new ATOM 468 N LEU A 939 11.416 -7.991 -22.359 1.00 64.41 N ATOM 469 CA LEU A 939 10.917 -7.388 -21.128 1.00 40.45 C ATOM 470 C LEU A 939 10.073 -8.382 -20.338 1.00 13.12 C ATOM 471 O LEU A 939 10.315 -8.616 -19.154 1.00 5.34 O ATOM 472 CB LEU A 939 10.091 -6.140 -21.448 1.00 21.33 C ATOM 473 CG LEU A 939 10.870 -4.829 -21.554 1.00 50.24 C ATOM 474 CD1 LEU A 939 10.014 -3.750 -22.200 1.00 72.52 C ATOM 475 CD2 LEU A 939 11.350 -4.380 -20.182 1.00 30.32 C ATOM 0 H LEU A 939 11.247 -7.437 -23.199 1.00 64.41 H new ATOM 0 HA LEU A 939 11.774 -7.103 -20.518 1.00 40.45 H new ATOM 0 HB2 LEU A 939 9.569 -6.306 -22.390 1.00 21.33 H new ATOM 0 HB3 LEU A 939 9.329 -6.025 -20.677 1.00 21.33 H new ATOM 0 HG LEU A 939 11.743 -4.998 -22.184 1.00 50.24 H new ATOM 0 HD11 LEU A 939 10.585 -2.824 -22.267 1.00 72.52 H new ATOM 0 HD12 LEU A 939 9.721 -4.069 -23.200 1.00 72.52 H new ATOM 0 HD13 LEU A 939 9.122 -3.583 -21.596 1.00 72.52 H new ATOM 0 HD21 LEU A 939 11.902 -3.445 -20.278 1.00 30.32 H new ATOM 0 HD22 LEU A 939 10.491 -4.229 -19.528 1.00 30.32 H new ATOM 0 HD23 LEU A 939 12.001 -5.144 -19.756 1.00 30.32 H new ATOM 487 N LYS A 940 9.081 -8.967 -21.001 1.00 12.51 N ATOM 488 CA LYS A 940 8.202 -9.939 -20.362 1.00 54.15 C ATOM 489 C LYS A 940 8.984 -11.171 -19.919 1.00 10.22 C ATOM 490 O LYS A 940 8.567 -11.890 -19.010 1.00 62.05 O ATOM 491 CB LYS A 940 7.082 -10.351 -21.321 1.00 14.35 C ATOM 492 CG LYS A 940 6.372 -9.174 -21.968 1.00 71.32 C ATOM 493 CD LYS A 940 5.697 -8.291 -20.932 1.00 71.22 C ATOM 494 CE LYS A 940 4.182 -8.419 -20.993 1.00 4.40 C ATOM 495 NZ LYS A 940 3.676 -9.467 -20.065 1.00 23.24 N ATOM 0 H LYS A 940 8.866 -8.785 -21.981 1.00 12.51 H new ATOM 0 HA LYS A 940 7.764 -9.472 -19.480 1.00 54.15 H new ATOM 0 HB2 LYS A 940 7.499 -10.987 -22.102 1.00 14.35 H new ATOM 0 HB3 LYS A 940 6.352 -10.951 -20.778 1.00 14.35 H new ATOM 0 HG2 LYS A 940 7.090 -8.584 -22.538 1.00 71.32 H new ATOM 0 HG3 LYS A 940 5.628 -9.541 -22.675 1.00 71.32 H new ATOM 0 HD2 LYS A 940 6.047 -8.564 -19.936 1.00 71.22 H new ATOM 0 HD3 LYS A 940 5.982 -7.252 -21.096 1.00 71.22 H new ATOM 0 HE2 LYS A 940 3.726 -7.461 -20.742 1.00 4.40 H new ATOM 0 HE3 LYS A 940 3.879 -8.659 -22.012 1.00 4.40 H new ATOM 0 HZ1 LYS A 940 2.640 -9.523 -20.136 1.00 23.24 H new ATOM 0 HZ2 LYS A 940 4.091 -10.386 -20.320 1.00 23.24 H new ATOM 0 HZ3 LYS A 940 3.943 -9.225 -19.089 1.00 23.24 H new ATOM 509 N LYS A 941 10.121 -11.408 -20.564 1.00 71.21 N ATOM 510 CA LYS A 941 10.964 -12.551 -20.235 1.00 31.41 C ATOM 511 C LYS A 941 11.719 -12.313 -18.931 1.00 45.35 C ATOM 512 O LYS A 941 11.838 -13.211 -18.097 1.00 60.05 O ATOM 513 CB LYS A 941 11.955 -12.824 -21.369 1.00 10.33 C ATOM 514 CG LYS A 941 12.656 -14.167 -21.255 1.00 14.54 C ATOM 515 CD LYS A 941 14.161 -14.025 -21.404 1.00 40.54 C ATOM 516 CE LYS A 941 14.905 -14.998 -20.503 1.00 61.34 C ATOM 517 NZ LYS A 941 16.011 -15.687 -21.225 1.00 2.34 N ATOM 0 H LYS A 941 10.480 -10.823 -21.318 1.00 71.21 H new ATOM 0 HA LYS A 941 10.320 -13.421 -20.107 1.00 31.41 H new ATOM 0 HB2 LYS A 941 11.426 -12.780 -22.321 1.00 10.33 H new ATOM 0 HB3 LYS A 941 12.704 -12.033 -21.384 1.00 10.33 H new ATOM 0 HG2 LYS A 941 12.426 -14.618 -20.290 1.00 14.54 H new ATOM 0 HG3 LYS A 941 12.276 -14.843 -22.021 1.00 14.54 H new ATOM 0 HD2 LYS A 941 14.443 -14.201 -22.442 1.00 40.54 H new ATOM 0 HD3 LYS A 941 14.457 -13.004 -21.162 1.00 40.54 H new ATOM 0 HE2 LYS A 941 15.310 -14.461 -19.645 1.00 61.34 H new ATOM 0 HE3 LYS A 941 14.207 -15.740 -20.115 1.00 61.34 H new ATOM 0 HZ1 LYS A 941 16.494 -16.342 -20.577 1.00 2.34 H new ATOM 0 HZ2 LYS A 941 15.622 -16.220 -22.029 1.00 2.34 H new ATOM 0 HZ3 LYS A 941 16.691 -14.981 -21.574 1.00 2.34 H new ATOM 531 N HIS A 942 12.228 -11.096 -18.762 1.00 32.35 N ATOM 532 CA HIS A 942 12.970 -10.739 -17.558 1.00 23.22 C ATOM 533 C HIS A 942 12.066 -10.035 -16.551 1.00 20.24 C ATOM 534 O HIS A 942 12.520 -9.600 -15.493 1.00 53.23 O ATOM 535 CB HIS A 942 14.156 -9.841 -17.912 1.00 15.31 C ATOM 536 CG HIS A 942 15.076 -10.437 -18.932 1.00 74.21 C ATOM 537 ND1 HIS A 942 15.964 -11.452 -18.643 1.00 55.20 N ATOM 538 CD2 HIS A 942 15.241 -10.158 -20.246 1.00 41.51 C ATOM 539 CE1 HIS A 942 16.637 -11.769 -19.735 1.00 34.25 C ATOM 540 NE2 HIS A 942 16.217 -10.999 -20.722 1.00 12.32 N ATOM 0 H HIS A 942 12.140 -10.342 -19.443 1.00 32.35 H new ATOM 0 HA HIS A 942 13.342 -11.658 -17.105 1.00 23.22 H new ATOM 0 HB2 HIS A 942 13.781 -8.888 -18.286 1.00 15.31 H new ATOM 0 HB3 HIS A 942 14.722 -9.627 -17.005 1.00 15.31 H new ATOM 0 HD1 HIS A 942 16.083 -11.889 -17.729 1.00 55.20 H new ATOM 0 HD2 HIS A 942 14.705 -9.413 -20.815 1.00 41.51 H new ATOM 0 HE1 HIS A 942 17.401 -12.529 -19.808 1.00 34.25 H new ATOM 548 N ASN A 943 10.785 -9.927 -16.887 1.00 72.12 N ATOM 549 CA ASN A 943 9.817 -9.275 -16.013 1.00 2.44 C ATOM 550 C ASN A 943 10.125 -7.787 -15.875 1.00 51.42 C ATOM 551 O ASN A 943 10.416 -7.300 -14.782 1.00 34.51 O ATOM 552 CB ASN A 943 9.818 -9.936 -14.633 1.00 72.52 C ATOM 553 CG ASN A 943 8.491 -9.778 -13.915 1.00 63.34 C ATOM 554 OD1 ASN A 943 8.172 -8.703 -13.408 1.00 31.22 O ATOM 555 ND2 ASN A 943 7.712 -10.852 -13.870 1.00 33.30 N ATOM 0 H ASN A 943 10.393 -10.283 -17.759 1.00 72.12 H new ATOM 0 HA ASN A 943 8.829 -9.385 -16.461 1.00 2.44 H new ATOM 0 HB2 ASN A 943 10.045 -10.997 -14.741 1.00 72.52 H new ATOM 0 HB3 ASN A 943 10.611 -9.500 -14.025 1.00 72.52 H new ATOM 0 HD21 ASN A 943 6.807 -10.807 -13.401 1.00 33.30 H new ATOM 0 HD22 ASN A 943 8.018 -11.723 -14.305 1.00 33.30 H new ATOM 562 N TYR A 944 10.058 -7.069 -16.991 1.00 4.00 N ATOM 563 CA TYR A 944 10.331 -5.637 -16.996 1.00 45.30 C ATOM 564 C TYR A 944 11.739 -5.349 -16.483 1.00 43.25 C ATOM 565 O TYR A 944 11.932 -4.515 -15.600 1.00 15.13 O ATOM 566 CB TYR A 944 9.303 -4.897 -16.138 1.00 63.24 C ATOM 567 CG TYR A 944 8.039 -4.536 -16.885 1.00 45.55 C ATOM 568 CD1 TYR A 944 7.459 -5.427 -17.780 1.00 13.44 C ATOM 569 CD2 TYR A 944 7.427 -3.303 -16.698 1.00 53.22 C ATOM 570 CE1 TYR A 944 6.304 -5.100 -18.465 1.00 64.40 C ATOM 571 CE2 TYR A 944 6.272 -2.969 -17.378 1.00 54.41 C ATOM 572 CZ TYR A 944 5.714 -3.871 -18.261 1.00 4.55 C ATOM 573 OH TYR A 944 4.565 -3.541 -18.941 1.00 14.12 O ATOM 0 H TYR A 944 9.817 -7.456 -17.904 1.00 4.00 H new ATOM 0 HA TYR A 944 10.259 -5.283 -18.024 1.00 45.30 H new ATOM 0 HB2 TYR A 944 9.044 -5.518 -15.280 1.00 63.24 H new ATOM 0 HB3 TYR A 944 9.757 -3.986 -15.747 1.00 63.24 H new ATOM 0 HD1 TYR A 944 7.918 -6.391 -17.943 1.00 13.44 H new ATOM 0 HD2 TYR A 944 7.862 -2.594 -16.009 1.00 53.22 H new ATOM 0 HE1 TYR A 944 5.866 -5.804 -19.157 1.00 64.40 H new ATOM 0 HE2 TYR A 944 5.808 -2.007 -17.219 1.00 54.41 H new ATOM 0 HH TYR A 944 4.279 -2.640 -18.682 1.00 14.12 H new ATOM 583 N ASN A 945 12.721 -6.046 -17.047 1.00 0.35 N ATOM 584 CA ASN A 945 14.112 -5.866 -16.648 1.00 2.14 C ATOM 585 C ASN A 945 14.963 -5.413 -17.830 1.00 40.03 C ATOM 586 O ASN A 945 15.634 -6.222 -18.471 1.00 23.51 O ATOM 587 CB ASN A 945 14.672 -7.168 -16.072 1.00 33.25 C ATOM 588 CG ASN A 945 15.661 -6.925 -14.948 1.00 63.53 C ATOM 589 OD1 ASN A 945 16.539 -6.068 -15.053 1.00 74.25 O ATOM 590 ND2 ASN A 945 15.524 -7.682 -13.865 1.00 42.25 N ATOM 0 H ASN A 945 12.579 -6.740 -17.781 1.00 0.35 H new ATOM 0 HA ASN A 945 14.146 -5.093 -15.881 1.00 2.14 H new ATOM 0 HB2 ASN A 945 13.850 -7.782 -15.703 1.00 33.25 H new ATOM 0 HB3 ASN A 945 15.160 -7.733 -16.866 1.00 33.25 H new ATOM 0 HD21 ASN A 945 16.161 -7.565 -13.077 1.00 42.25 H new ATOM 0 HD22 ASN A 945 14.782 -8.380 -13.821 1.00 42.25 H new ATOM 597 N ILE A 946 14.930 -4.115 -18.113 1.00 60.22 N ATOM 598 CA ILE A 946 15.699 -3.555 -19.217 1.00 42.32 C ATOM 599 C ILE A 946 17.160 -3.986 -19.145 1.00 31.55 C ATOM 600 O ILE A 946 17.782 -4.284 -20.165 1.00 23.20 O ATOM 601 CB ILE A 946 15.630 -2.016 -19.227 1.00 63.13 C ATOM 602 CG1 ILE A 946 16.509 -1.452 -20.346 1.00 55.10 C ATOM 603 CG2 ILE A 946 16.058 -1.458 -17.878 1.00 51.12 C ATOM 604 CD1 ILE A 946 16.133 -1.956 -21.722 1.00 34.02 C ATOM 0 H ILE A 946 14.379 -3.432 -17.593 1.00 60.22 H new ATOM 0 HA ILE A 946 15.255 -3.937 -20.136 1.00 42.32 H new ATOM 0 HB ILE A 946 14.599 -1.714 -19.413 1.00 63.13 H new ATOM 0 HG12 ILE A 946 16.443 -0.364 -20.336 1.00 55.10 H new ATOM 0 HG13 ILE A 946 17.549 -1.710 -20.145 1.00 55.10 H new ATOM 0 HG21 ILE A 946 16.004 -0.370 -17.901 1.00 51.12 H new ATOM 0 HG22 ILE A 946 15.396 -1.838 -17.100 1.00 51.12 H new ATOM 0 HG23 ILE A 946 17.082 -1.766 -17.665 1.00 51.12 H new ATOM 0 HD11 ILE A 946 16.797 -1.515 -22.465 1.00 34.02 H new ATOM 0 HD12 ILE A 946 16.227 -3.042 -21.750 1.00 34.02 H new ATOM 0 HD13 ILE A 946 15.103 -1.675 -21.944 1.00 34.02 H new ATOM 616 N LEU A 947 17.701 -4.020 -17.932 1.00 23.20 N ATOM 617 CA LEU A 947 19.090 -4.418 -17.725 1.00 15.03 C ATOM 618 C LEU A 947 19.371 -5.770 -18.373 1.00 43.52 C ATOM 619 O LEU A 947 20.323 -5.914 -19.140 1.00 52.42 O ATOM 620 CB LEU A 947 19.405 -4.481 -16.229 1.00 74.42 C ATOM 621 CG LEU A 947 19.041 -3.241 -15.413 1.00 54.53 C ATOM 622 CD1 LEU A 947 19.457 -3.415 -13.961 1.00 71.41 C ATOM 623 CD2 LEU A 947 19.689 -2.000 -16.010 1.00 65.34 C ATOM 0 H LEU A 947 17.200 -3.777 -17.077 1.00 23.20 H new ATOM 0 HA LEU A 947 19.731 -3.671 -18.194 1.00 15.03 H new ATOM 0 HB2 LEU A 947 18.882 -5.337 -15.804 1.00 74.42 H new ATOM 0 HB3 LEU A 947 20.472 -4.669 -16.111 1.00 74.42 H new ATOM 0 HG LEU A 947 17.959 -3.114 -15.446 1.00 54.53 H new ATOM 0 HD11 LEU A 947 19.189 -2.522 -13.396 1.00 71.41 H new ATOM 0 HD12 LEU A 947 18.946 -4.279 -13.537 1.00 71.41 H new ATOM 0 HD13 LEU A 947 20.535 -3.569 -13.907 1.00 71.41 H new ATOM 0 HD21 LEU A 947 19.419 -1.127 -15.416 1.00 65.34 H new ATOM 0 HD22 LEU A 947 20.773 -2.119 -16.008 1.00 65.34 H new ATOM 0 HD23 LEU A 947 19.340 -1.864 -17.034 1.00 65.34 H new ATOM 635 N GLN A 948 18.536 -6.755 -18.061 1.00 24.40 N ATOM 636 CA GLN A 948 18.696 -8.095 -18.615 1.00 14.20 C ATOM 637 C GLN A 948 18.284 -8.129 -20.083 1.00 42.02 C ATOM 638 O GLN A 948 18.832 -8.897 -20.874 1.00 41.34 O ATOM 639 CB GLN A 948 17.865 -9.102 -17.817 1.00 4.41 C ATOM 640 CG GLN A 948 18.235 -9.163 -16.344 1.00 12.45 C ATOM 641 CD GLN A 948 19.613 -9.751 -16.111 1.00 54.32 C ATOM 642 OE1 GLN A 948 20.550 -9.040 -15.748 1.00 64.10 O ATOM 643 NE2 GLN A 948 19.742 -11.056 -16.320 1.00 5.34 N ATOM 0 H GLN A 948 17.743 -6.651 -17.428 1.00 24.40 H new ATOM 0 HA GLN A 948 19.749 -8.367 -18.545 1.00 14.20 H new ATOM 0 HB2 GLN A 948 16.810 -8.843 -17.908 1.00 4.41 H new ATOM 0 HB3 GLN A 948 17.989 -10.092 -18.256 1.00 4.41 H new ATOM 0 HG2 GLN A 948 18.197 -8.159 -15.922 1.00 12.45 H new ATOM 0 HG3 GLN A 948 17.495 -9.761 -15.812 1.00 12.45 H new ATOM 0 HE21 GLN A 948 18.938 -11.606 -16.621 1.00 5.34 H new ATOM 0 HE22 GLN A 948 20.646 -11.508 -16.180 1.00 5.34 H new ATOM 652 N VAL A 949 17.315 -7.292 -20.441 1.00 23.21 N ATOM 653 CA VAL A 949 16.831 -7.226 -21.814 1.00 73.04 C ATOM 654 C VAL A 949 17.957 -6.867 -22.778 1.00 35.03 C ATOM 655 O VAL A 949 18.271 -7.628 -23.693 1.00 41.42 O ATOM 656 CB VAL A 949 15.696 -6.194 -21.960 1.00 65.33 C ATOM 657 CG1 VAL A 949 15.297 -6.043 -23.420 1.00 53.21 C ATOM 658 CG2 VAL A 949 14.500 -6.594 -21.110 1.00 62.41 C ATOM 0 H VAL A 949 16.850 -6.650 -19.799 1.00 23.21 H new ATOM 0 HA VAL A 949 16.447 -8.215 -22.062 1.00 73.04 H new ATOM 0 HB VAL A 949 16.058 -5.229 -21.605 1.00 65.33 H new ATOM 0 HG11 VAL A 949 14.494 -5.310 -23.504 1.00 53.21 H new ATOM 0 HG12 VAL A 949 16.157 -5.707 -23.999 1.00 53.21 H new ATOM 0 HG13 VAL A 949 14.953 -7.003 -23.804 1.00 53.21 H new ATOM 0 HG21 VAL A 949 13.708 -5.854 -21.225 1.00 62.41 H new ATOM 0 HG22 VAL A 949 14.135 -7.569 -21.432 1.00 62.41 H new ATOM 0 HG23 VAL A 949 14.799 -6.646 -20.063 1.00 62.41 H new ATOM 668 N VAL A 950 18.561 -5.703 -22.565 1.00 2.50 N ATOM 669 CA VAL A 950 19.654 -5.242 -23.413 1.00 61.43 C ATOM 670 C VAL A 950 20.796 -6.253 -23.435 1.00 53.51 C ATOM 671 O VAL A 950 21.343 -6.566 -24.493 1.00 1.21 O ATOM 672 CB VAL A 950 20.197 -3.881 -22.940 1.00 51.21 C ATOM 673 CG1 VAL A 950 21.391 -3.459 -23.783 1.00 74.44 C ATOM 674 CG2 VAL A 950 19.102 -2.826 -22.987 1.00 11.15 C ATOM 0 H VAL A 950 18.312 -5.061 -21.812 1.00 2.50 H new ATOM 0 HA VAL A 950 19.249 -5.133 -24.419 1.00 61.43 H new ATOM 0 HB VAL A 950 20.530 -3.982 -21.907 1.00 51.21 H new ATOM 0 HG11 VAL A 950 21.761 -2.495 -23.434 1.00 74.44 H new ATOM 0 HG12 VAL A 950 22.181 -4.205 -23.694 1.00 74.44 H new ATOM 0 HG13 VAL A 950 21.088 -3.375 -24.827 1.00 74.44 H new ATOM 0 HG21 VAL A 950 19.503 -1.870 -22.649 1.00 11.15 H new ATOM 0 HG22 VAL A 950 18.737 -2.726 -24.009 1.00 11.15 H new ATOM 0 HG23 VAL A 950 18.280 -3.125 -22.336 1.00 11.15 H new ATOM 684 N THR A 951 21.151 -6.761 -22.259 1.00 43.03 N ATOM 685 CA THR A 951 22.228 -7.736 -22.142 1.00 45.34 C ATOM 686 C THR A 951 21.984 -8.936 -23.049 1.00 63.34 C ATOM 687 O THR A 951 22.914 -9.464 -23.659 1.00 21.15 O ATOM 688 CB THR A 951 22.387 -8.227 -20.691 1.00 54.10 C ATOM 689 OG1 THR A 951 22.700 -7.125 -19.832 1.00 44.23 O ATOM 690 CG2 THR A 951 23.480 -9.280 -20.592 1.00 75.43 C ATOM 0 H THR A 951 20.708 -6.513 -21.374 1.00 43.03 H new ATOM 0 HA THR A 951 23.145 -7.232 -22.449 1.00 45.34 H new ATOM 0 HB THR A 951 21.444 -8.675 -20.378 1.00 54.10 H new ATOM 0 HG1 THR A 951 21.872 -6.750 -19.467 1.00 44.23 H new ATOM 0 HG21 THR A 951 23.573 -9.611 -19.558 1.00 75.43 H new ATOM 0 HG22 THR A 951 23.224 -10.131 -21.224 1.00 75.43 H new ATOM 0 HG23 THR A 951 24.427 -8.854 -20.923 1.00 75.43 H new ATOM 698 N GLU A 952 20.728 -9.362 -23.135 1.00 32.14 N ATOM 699 CA GLU A 952 20.363 -10.502 -23.968 1.00 50.52 C ATOM 700 C GLU A 952 20.549 -10.175 -25.447 1.00 72.13 C ATOM 701 O GLU A 952 21.217 -10.908 -26.177 1.00 71.45 O ATOM 702 CB GLU A 952 18.913 -10.912 -23.704 1.00 11.25 C ATOM 703 CG GLU A 952 18.655 -12.396 -23.899 1.00 70.41 C ATOM 704 CD GLU A 952 19.560 -13.263 -23.045 1.00 72.21 C ATOM 705 OE1 GLU A 952 19.878 -12.851 -21.910 1.00 63.42 O ATOM 706 OE2 GLU A 952 19.949 -14.354 -23.512 1.00 61.05 O ATOM 0 H GLU A 952 19.946 -8.935 -22.638 1.00 32.14 H new ATOM 0 HA GLU A 952 21.020 -11.333 -23.711 1.00 50.52 H new ATOM 0 HB2 GLU A 952 18.646 -10.637 -22.684 1.00 11.25 H new ATOM 0 HB3 GLU A 952 18.258 -10.348 -24.368 1.00 11.25 H new ATOM 0 HG2 GLU A 952 17.615 -12.615 -23.657 1.00 70.41 H new ATOM 0 HG3 GLU A 952 18.799 -12.651 -24.949 1.00 70.41 H new ATOM 713 N LEU A 953 19.953 -9.071 -25.883 1.00 11.44 N ATOM 714 CA LEU A 953 20.051 -8.646 -27.275 1.00 4.13 C ATOM 715 C LEU A 953 21.509 -8.559 -27.716 1.00 10.34 C ATOM 716 O LEU A 953 21.848 -8.905 -28.848 1.00 22.52 O ATOM 717 CB LEU A 953 19.367 -7.291 -27.465 1.00 3.02 C ATOM 718 CG LEU A 953 17.914 -7.201 -26.997 1.00 62.32 C ATOM 719 CD1 LEU A 953 17.277 -5.907 -27.479 1.00 63.23 C ATOM 720 CD2 LEU A 953 17.121 -8.404 -27.488 1.00 12.51 C ATOM 0 H LEU A 953 19.396 -8.453 -25.292 1.00 11.44 H new ATOM 0 HA LEU A 953 19.547 -9.390 -27.893 1.00 4.13 H new ATOM 0 HB2 LEU A 953 19.946 -6.536 -26.933 1.00 3.02 H new ATOM 0 HB3 LEU A 953 19.403 -7.033 -28.523 1.00 3.02 H new ATOM 0 HG LEU A 953 17.902 -7.203 -25.907 1.00 62.32 H new ATOM 0 HD11 LEU A 953 16.243 -5.861 -27.136 1.00 63.23 H new ATOM 0 HD12 LEU A 953 17.830 -5.058 -27.078 1.00 63.23 H new ATOM 0 HD13 LEU A 953 17.300 -5.874 -28.568 1.00 63.23 H new ATOM 0 HD21 LEU A 953 16.089 -8.324 -27.146 1.00 12.51 H new ATOM 0 HD22 LEU A 953 17.141 -8.433 -28.577 1.00 12.51 H new ATOM 0 HD23 LEU A 953 17.564 -9.318 -27.093 1.00 12.51 H new ATOM 732 N LEU A 954 22.368 -8.096 -26.814 1.00 14.41 N ATOM 733 CA LEU A 954 23.790 -7.965 -27.109 1.00 23.04 C ATOM 734 C LEU A 954 24.458 -9.334 -27.190 1.00 35.22 C ATOM 735 O LEU A 954 25.061 -9.681 -28.204 1.00 64.15 O ATOM 736 CB LEU A 954 24.477 -7.113 -26.039 1.00 74.23 C ATOM 737 CG LEU A 954 25.695 -6.313 -26.499 1.00 45.42 C ATOM 738 CD1 LEU A 954 25.303 -5.316 -27.579 1.00 62.32 C ATOM 739 CD2 LEU A 954 26.340 -5.598 -25.320 1.00 52.23 C ATOM 0 H LEU A 954 22.104 -7.805 -25.873 1.00 14.41 H new ATOM 0 HA LEU A 954 23.891 -7.474 -28.077 1.00 23.04 H new ATOM 0 HB2 LEU A 954 23.744 -6.418 -25.631 1.00 74.23 H new ATOM 0 HB3 LEU A 954 24.784 -7.768 -25.224 1.00 74.23 H new ATOM 0 HG LEU A 954 26.423 -7.007 -26.920 1.00 45.42 H new ATOM 0 HD11 LEU A 954 26.183 -4.756 -27.894 1.00 62.32 H new ATOM 0 HD12 LEU A 954 24.888 -5.850 -28.434 1.00 62.32 H new ATOM 0 HD13 LEU A 954 24.556 -4.627 -27.184 1.00 62.32 H new ATOM 0 HD21 LEU A 954 27.206 -5.033 -25.666 1.00 52.23 H new ATOM 0 HD22 LEU A 954 25.619 -4.916 -24.869 1.00 52.23 H new ATOM 0 HD23 LEU A 954 26.658 -6.332 -24.579 1.00 52.23 H new ATOM 751 N GLN A 955 24.342 -10.108 -26.115 1.00 52.13 N ATOM 752 CA GLN A 955 24.933 -11.440 -26.066 1.00 51.14 C ATOM 753 C GLN A 955 24.485 -12.278 -27.259 1.00 63.23 C ATOM 754 O GLN A 955 25.308 -12.866 -27.962 1.00 64.03 O ATOM 755 CB GLN A 955 24.551 -12.143 -24.762 1.00 44.44 C ATOM 756 CG GLN A 955 25.370 -11.688 -23.565 1.00 31.54 C ATOM 757 CD GLN A 955 25.327 -12.680 -22.419 1.00 11.04 C ATOM 758 OE1 GLN A 955 25.215 -13.888 -22.631 1.00 42.33 O ATOM 759 NE2 GLN A 955 25.416 -12.174 -21.194 1.00 73.11 N ATOM 0 H GLN A 955 23.845 -9.836 -25.267 1.00 52.13 H new ATOM 0 HA GLN A 955 26.017 -11.331 -26.108 1.00 51.14 H new ATOM 0 HB2 GLN A 955 23.495 -11.965 -24.558 1.00 44.44 H new ATOM 0 HB3 GLN A 955 24.674 -13.219 -24.889 1.00 44.44 H new ATOM 0 HG2 GLN A 955 26.405 -11.539 -23.873 1.00 31.54 H new ATOM 0 HG3 GLN A 955 24.998 -10.723 -23.220 1.00 31.54 H new ATOM 0 HE21 GLN A 955 25.508 -11.167 -21.064 1.00 73.11 H new ATOM 0 HE22 GLN A 955 25.393 -12.793 -20.384 1.00 73.11 H new ATOM 768 N LEU A 956 23.177 -12.329 -27.482 1.00 73.42 N ATOM 769 CA LEU A 956 22.619 -13.096 -28.591 1.00 32.54 C ATOM 770 C LEU A 956 23.254 -12.681 -29.914 1.00 74.40 C ATOM 771 O LEU A 956 23.481 -13.512 -30.792 1.00 74.23 O ATOM 772 CB LEU A 956 21.103 -12.905 -28.657 1.00 34.10 C ATOM 773 CG LEU A 956 20.411 -13.451 -29.907 1.00 3.21 C ATOM 774 CD1 LEU A 956 20.740 -14.923 -30.099 1.00 62.11 C ATOM 775 CD2 LEU A 956 18.906 -13.246 -29.816 1.00 61.12 C ATOM 0 H LEU A 956 22.482 -11.849 -26.910 1.00 73.42 H new ATOM 0 HA LEU A 956 22.839 -14.150 -28.419 1.00 32.54 H new ATOM 0 HB2 LEU A 956 20.659 -13.381 -27.783 1.00 34.10 H new ATOM 0 HB3 LEU A 956 20.888 -11.839 -28.583 1.00 34.10 H new ATOM 0 HG LEU A 956 20.780 -12.902 -30.773 1.00 3.21 H new ATOM 0 HD11 LEU A 956 20.239 -15.294 -30.993 1.00 62.11 H new ATOM 0 HD12 LEU A 956 21.818 -15.043 -30.210 1.00 62.11 H new ATOM 0 HD13 LEU A 956 20.400 -15.488 -29.231 1.00 62.11 H new ATOM 0 HD21 LEU A 956 18.430 -13.640 -30.714 1.00 61.12 H new ATOM 0 HD22 LEU A 956 18.520 -13.769 -28.941 1.00 61.12 H new ATOM 0 HD23 LEU A 956 18.688 -12.182 -29.728 1.00 61.12 H new ATOM 787 N ASN A 957 23.540 -11.390 -30.048 1.00 75.30 N ATOM 788 CA ASN A 957 24.150 -10.865 -31.264 1.00 1.12 C ATOM 789 C ASN A 957 25.663 -10.747 -31.106 1.00 11.24 C ATOM 790 O ASN A 957 26.300 -9.910 -31.743 1.00 43.31 O ATOM 791 CB ASN A 957 23.554 -9.499 -31.609 1.00 40.25 C ATOM 792 CG ASN A 957 23.540 -9.235 -33.103 1.00 22.22 C ATOM 793 OD1 ASN A 957 23.040 -10.046 -33.883 1.00 2.31 O ATOM 794 ND2 ASN A 957 24.091 -8.097 -33.508 1.00 2.35 N ATOM 0 H ASN A 957 23.359 -10.689 -29.330 1.00 75.30 H new ATOM 0 HA ASN A 957 23.940 -11.561 -32.076 1.00 1.12 H new ATOM 0 HB2 ASN A 957 22.536 -9.442 -31.223 1.00 40.25 H new ATOM 0 HB3 ASN A 957 24.128 -8.718 -31.110 1.00 40.25 H new ATOM 0 HD21 ASN A 957 24.112 -7.865 -34.501 1.00 2.35 H new ATOM 0 HD22 ASN A 957 24.494 -7.454 -32.826 1.00 2.35 H new ATOM 801 N ASN A 958 26.231 -11.592 -30.251 1.00 52.04 N ATOM 802 CA ASN A 958 27.669 -11.583 -30.009 1.00 51.30 C ATOM 803 C ASN A 958 28.365 -12.669 -30.824 1.00 11.41 C ATOM 804 O ASN A 958 29.420 -12.437 -31.412 1.00 23.01 O ATOM 805 CB ASN A 958 27.958 -11.783 -28.520 1.00 15.11 C ATOM 806 CG ASN A 958 29.339 -11.295 -28.128 1.00 12.11 C ATOM 807 OD1 ASN A 958 30.167 -10.988 -28.985 1.00 42.32 O ATOM 808 ND2 ASN A 958 29.593 -11.222 -26.827 1.00 1.34 N ATOM 0 H ASN A 958 25.717 -12.291 -29.715 1.00 52.04 H new ATOM 0 HA ASN A 958 28.058 -10.614 -30.321 1.00 51.30 H new ATOM 0 HB2 ASN A 958 27.208 -11.253 -27.933 1.00 15.11 H new ATOM 0 HB3 ASN A 958 27.866 -12.841 -28.274 1.00 15.11 H new ATOM 0 HD21 ASN A 958 30.505 -10.901 -26.503 1.00 1.34 H new ATOM 0 HD22 ASN A 958 28.876 -11.487 -26.152 1.00 1.34 H new ATOM 815 N ASN A 959 27.765 -13.854 -30.854 1.00 21.32 N ATOM 816 CA ASN A 959 28.327 -14.977 -31.596 1.00 41.45 C ATOM 817 C ASN A 959 27.354 -15.462 -32.667 1.00 23.22 C ATOM 818 O ASN A 959 26.268 -14.907 -32.830 1.00 42.20 O ATOM 819 CB ASN A 959 28.670 -16.124 -30.645 1.00 22.43 C ATOM 820 CG ASN A 959 27.437 -16.735 -30.007 1.00 1.44 C ATOM 821 OD1 ASN A 959 26.638 -17.389 -30.676 1.00 33.21 O ATOM 822 ND2 ASN A 959 27.278 -16.522 -28.706 1.00 14.24 N ATOM 0 H ASN A 959 26.890 -14.062 -30.373 1.00 21.32 H new ATOM 0 HA ASN A 959 29.239 -14.636 -32.086 1.00 41.45 H new ATOM 0 HB2 ASN A 959 29.213 -16.895 -31.191 1.00 22.43 H new ATOM 0 HB3 ASN A 959 29.336 -15.758 -29.864 1.00 22.43 H new ATOM 0 HD21 ASN A 959 26.467 -16.907 -28.221 1.00 14.24 H new ATOM 0 HD22 ASN A 959 27.967 -15.973 -28.191 1.00 14.24 H new TER 829 ASN A 959