Browse entries in the PDBbind-CN Database
HEADER 4ZYZ_COMPLEX COMPND 4ZYZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 200 ALA ARG VAL ALA VAL LEU ILE SER GLY THR GLY SER ASN SEQRES 2 A 200 LEU GLN ALA LEU ILE ASP SER THR ARG GLU PRO ASN SER SEQRES 3 A 200 SER ALA GLN ILE ASP ILE VAL ILE SER ASN LYS ALA ALA SEQRES 4 A 200 VAL ALA GLY LEU ASP LYS ALA GLU ARG ALA GLY ILE PRO SEQRES 5 A 200 THR ARG VAL ILE ASN HIS LYS LEU TYR LYS ASN ARG VAL SEQRES 6 A 200 GLU PHE ASP SER ALA ILE ASP LEU VAL LEU GLU GLU PHE SEQRES 7 A 200 SER ILE ASP ILE VAL CYS LEU ALA GLY PHE MET ARG ILE SEQRES 8 A 200 LEU SER GLY PRO PHE VAL GLN LYS TRP ASN GLY LYS MET SEQRES 9 A 200 LEU ASN ILE HIS PRO SER LEU LEU PRO SER PHE LYS GLY SEQRES 10 A 200 SER ASN ALA HIS GLU GLN ALA LEU GLU THR GLY VAL THR SEQRES 11 A 200 VAL THR GLY CYS THR VAL HIS PHE VAL ALA GLU ASP VAL SEQRES 12 A 200 ASP ALA GLY GLN ILE ILE LEU GLN GLU ALA VAL PRO VAL SEQRES 13 A 200 LYS ARG GLY ASP THR VAL ALA THR LEU SER GLU ARG VAL SEQRES 14 A 200 LYS LEU ALA GLU HIS LYS ILE PHE PRO ALA ALA LEU GLN SEQRES 15 A 200 LEU VAL ALA SER GLY THR VAL GLN LEU GLY GLU ASN GLY SEQRES 16 A 200 LYS ILE CYS TRP VAL HET UNN A 404 53 ATOM 1 N ALA A 808 -40.267 22.790 37.754 1.00 12.95 N ATOM 2 CA ALA A 808 -38.877 22.869 37.302 1.00 13.29 C ATOM 3 C ALA A 808 -38.714 23.878 36.173 1.00 11.72 C ATOM 4 O ALA A 808 -39.568 23.971 35.281 1.00 12.45 O ATOM 5 CB ALA A 808 -38.391 21.505 36.851 1.00 14.21 C ATOM 6 HN3 ALA A 808 -40.872 22.498 36.960 1.00 0.00 H ATOM 7 HN2 ALA A 808 -40.572 23.723 38.099 1.00 0.00 H ATOM 8 HN1 ALA A 808 -40.341 22.094 38.523 1.00 0.00 H ATOM 9 N ARG A 809 -37.595 24.595 36.214 1.00 11.28 N ATOM 10 CA ARG A 809 -37.289 25.676 35.286 1.00 9.70 C ATOM 11 C ARG A 809 -36.400 25.147 34.177 1.00 11.77 C ATOM 12 O ARG A 809 -35.356 24.544 34.452 1.00 11.71 O ATOM 13 CB ARG A 809 -36.605 26.825 36.035 1.00 10.28 C ATOM 14 CG ARG A 809 -37.505 27.407 37.120 1.00 10.87 C ATOM 15 CD ARG A 809 -36.803 28.490 37.914 1.00 12.59 C ATOM 16 NE ARG A 809 -36.368 29.567 37.037 1.00 12.66 N ATOM 17 CZ ARG A 809 -37.164 30.533 36.600 1.00 16.11 C ATOM 18 NH1 ARG A 809 -38.439 30.580 36.999 1.00 13.66 N ATOM 19 NH2 ARG A 809 -36.678 31.461 35.778 1.00 15.09 N ATOM 20 HE ARG A 809 -35.373 29.580 36.735 1.00 0.00 H ATOM 21 HH12 ARG A 809 -39.064 31.338 36.656 1.00 0.00 H ATOM 22 HH11 ARG A 809 -38.806 29.859 37.652 1.00 0.00 H ATOM 23 HH22 ARG A 809 -37.295 32.222 35.430 1.00 0.00 H ATOM 24 HH21 ARG A 809 -35.681 31.424 35.484 1.00 0.00 H ATOM 25 H ARG A 809 -36.897 24.371 36.952 1.00 0.00 H ATOM 26 N VAL A 810 -36.817 25.373 32.930 1.00 10.71 N ATOM 27 CA VAL A 810 -36.179 24.725 31.785 1.00 11.58 C ATOM 28 C VAL A 810 -35.600 25.722 30.784 1.00 12.44 C ATOM 29 O VAL A 810 -36.215 26.738 30.460 1.00 13.32 O ATOM 30 CB VAL A 810 -37.185 23.804 31.050 1.00 10.35 C ATOM 31 CG1 VAL A 810 -36.535 23.119 29.834 1.00 12.64 C ATOM 32 CG2 VAL A 810 -37.742 22.760 32.013 1.00 11.52 C ATOM 33 H VAL A 810 -37.612 26.024 32.769 1.00 0.00 H ATOM 34 N ALA A 811 -34.395 25.426 30.313 1.00 11.98 N ATOM 35 CA ALA A 811 -33.821 26.127 29.172 1.00 12.35 C ATOM 36 C ALA A 811 -33.882 25.198 27.983 1.00 12.68 C ATOM 37 O ALA A 811 -33.609 24.014 28.129 1.00 13.02 O ATOM 38 CB ALA A 811 -32.394 26.518 29.441 1.00 14.13 C ATOM 39 H ALA A 811 -33.845 24.672 30.772 1.00 0.00 H ATOM 40 N VAL A 812 -34.244 25.719 26.814 1.00 13.15 N ATOM 41 CA VAL A 812 -34.172 24.913 25.600 1.00 13.36 C ATOM 42 C VAL A 812 -33.113 25.503 24.693 1.00 14.79 C ATOM 43 O VAL A 812 -33.143 26.697 24.383 1.00 15.70 O ATOM 44 CB VAL A 812 -35.519 24.835 24.862 1.00 13.57 C ATOM 45 CG1 VAL A 812 -35.374 23.951 23.617 1.00 14.64 C ATOM 46 CG2 VAL A 812 -36.615 24.289 25.793 1.00 14.51 C ATOM 47 H VAL A 812 -34.579 26.702 26.765 1.00 0.00 H ATOM 48 N LEU A 813 -32.155 24.670 24.297 1.00 14.25 N ATOM 49 CA LEU A 813 -31.085 25.104 23.402 1.00 16.54 C ATOM 50 C LEU A 813 -31.380 24.604 21.993 1.00 16.87 C ATOM 51 O LEU A 813 -31.762 23.447 21.807 1.00 16.17 O ATOM 52 CB LEU A 813 -29.731 24.582 23.881 1.00 18.15 C ATOM 53 CG LEU A 813 -28.975 25.399 24.931 1.00 19.88 C ATOM 54 CD1 LEU A 813 -29.845 25.717 26.137 1.00 19.79 C ATOM 55 CD2 LEU A 813 -27.745 24.628 25.362 1.00 18.38 C ATOM 56 H LEU A 813 -32.168 23.686 24.633 1.00 0.00 H ATOM 57 N ILE A 814 -31.226 25.481 21.004 1.00 16.65 N ATOM 58 CA ILE A 814 -31.557 25.158 19.617 1.00 17.24 C ATOM 59 C ILE A 814 -30.451 25.633 18.675 1.00 22.49 C ATOM 60 O ILE A 814 -29.603 26.438 19.075 1.00 21.28 O ATOM 61 CB ILE A 814 -32.887 25.808 19.187 1.00 17.55 C ATOM 62 CG1 ILE A 814 -32.761 27.337 19.206 1.00 20.01 C ATOM 63 CG2 ILE A 814 -34.037 25.349 20.088 1.00 16.98 C ATOM 64 CD1 ILE A 814 -33.934 28.068 18.568 1.00 22.73 C ATOM 65 H ILE A 814 -30.858 26.428 21.225 1.00 0.00 H ATOM 66 N SER A 815 -30.457 25.132 17.435 1.00 19.88 N ATOM 67 CA SER A 815 -29.590 25.651 16.370 1.00 20.11 C ATOM 68 C SER A 815 -30.362 25.924 15.080 1.00 21.67 C ATOM 69 O SER A 815 -29.778 26.389 14.097 1.00 25.25 O ATOM 70 CB SER A 815 -28.445 24.676 16.057 1.00 22.17 C ATOM 71 OG SER A 815 -27.658 24.403 17.205 1.00 21.84 O ATOM 72 HG SER A 815 -27.265 25.247 17.543 1.00 0.00 H ATOM 73 H SER A 815 -31.100 24.345 17.217 1.00 0.00 H ATOM 74 N GLY A 816 -31.662 25.634 15.066 1.00 22.32 N ATOM 75 CA GLY A 816 -32.389 25.654 13.807 1.00 21.20 C ATOM 76 C GLY A 816 -33.887 25.893 13.816 1.00 22.31 C ATOM 77 O GLY A 816 -34.378 26.829 14.448 1.00 24.36 O ATOM 78 H GLY A 816 -32.154 25.395 15.950 1.00 0.00 H ATOM 79 N THR A 817 -34.606 25.025 13.102 1.00 21.71 N ATOM 80 CA THR A 817 -36.034 25.186 12.828 1.00 26.54 C ATOM 81 C THR A 817 -36.894 25.290 14.090 1.00 25.06 C ATOM 82 O THR A 817 -37.786 26.136 14.188 1.00 22.79 O ATOM 83 CB THR A 817 -36.550 24.012 11.966 1.00 25.55 C ATOM 84 OG1 THR A 817 -35.848 23.995 10.716 1.00 27.11 O ATOM 85 CG2 THR A 817 -38.050 24.136 11.709 1.00 28.78 C ATOM 86 HG1 THR A 817 -36.178 23.243 10.163 1.00 0.00 H ATOM 87 H THR A 817 -34.124 24.187 12.719 1.00 0.00 H ATOM 88 N GLY A 818 -36.630 24.415 15.051 1.00 19.28 N ATOM 89 CA GLY A 818 -37.318 24.470 16.324 1.00 18.43 C ATOM 90 C GLY A 818 -38.653 23.750 16.413 1.00 21.44 C ATOM 91 O GLY A 818 -39.490 24.113 17.245 1.00 17.99 O ATOM 92 H GLY A 818 -35.916 23.676 14.887 1.00 0.00 H ATOM 93 N SER A 819 -38.870 22.723 15.594 1.00 16.70 N ATOM 94 CA SER A 819 -40.113 21.962 15.735 1.00 15.93 C ATOM 95 C SER A 819 -40.153 21.242 17.082 1.00 16.76 C ATOM 96 O SER A 819 -41.219 21.160 17.697 1.00 14.89 O ATOM 97 CB SER A 819 -40.308 20.963 14.578 1.00 15.90 C ATOM 98 OG SER A 819 -39.411 19.870 14.666 1.00 16.86 O ATOM 99 HG SER A 819 -39.560 19.390 15.519 1.00 0.00 H ATOM 100 H SER A 819 -38.170 22.466 14.868 1.00 0.00 H ATOM 101 N ASN A 820 -39.020 20.713 17.551 1.00 13.41 N ATOM 102 CA ASN A 820 -39.019 20.102 18.880 1.00 11.31 C ATOM 103 C ASN A 820 -39.286 21.150 19.953 1.00 12.24 C ATOM 104 O ASN A 820 -40.024 20.883 20.904 1.00 12.23 O ATOM 105 CB ASN A 820 -37.703 19.364 19.159 1.00 11.11 C ATOM 106 CG ASN A 820 -37.717 17.934 18.630 1.00 12.03 C ATOM 107 OD1 ASN A 820 -38.398 17.071 19.173 1.00 14.62 O ATOM 108 ND2 ASN A 820 -36.952 17.676 17.575 1.00 14.31 N ATOM 109 HD22 ASN A 820 -36.389 18.436 17.143 1.00 0.00 H ATOM 110 HD21 ASN A 820 -36.916 16.714 17.181 1.00 0.00 H ATOM 111 H ASN A 820 -38.151 20.735 16.980 1.00 0.00 H ATOM 112 N LEU A 821 -38.696 22.335 19.804 1.00 13.18 N ATOM 113 CA LEU A 821 -38.976 23.434 20.725 1.00 13.42 C ATOM 114 C LEU A 821 -40.476 23.719 20.784 1.00 13.51 C ATOM 115 O LEU A 821 -41.034 23.853 21.866 1.00 13.95 O ATOM 116 CB LEU A 821 -38.217 24.699 20.313 1.00 12.90 C ATOM 117 CG LEU A 821 -38.672 25.992 20.997 1.00 12.76 C ATOM 118 CD1 LEU A 821 -38.470 25.937 22.518 1.00 16.02 C ATOM 119 CD2 LEU A 821 -37.925 27.169 20.398 1.00 15.13 C ATOM 120 H LEU A 821 -38.027 22.480 19.021 1.00 0.00 H ATOM 121 N GLN A 822 -41.136 23.786 19.631 1.00 12.33 N ATOM 122 CA GLN A 822 -42.567 24.076 19.632 1.00 13.53 C ATOM 123 C GLN A 822 -43.359 22.996 20.371 1.00 13.08 C ATOM 124 O GLN A 822 -44.284 23.312 21.126 1.00 12.74 O ATOM 125 CB GLN A 822 -43.103 24.228 18.212 1.00 14.78 C ATOM 126 CG GLN A 822 -44.560 24.684 18.187 1.00 17.88 C ATOM 127 CD GLN A 822 -44.759 26.062 18.808 1.00 19.27 C ATOM 128 OE1 GLN A 822 -44.119 27.038 18.403 1.00 23.41 O ATOM 129 NE2 GLN A 822 -45.656 26.152 19.787 1.00 19.41 N ATOM 130 HE22 GLN A 822 -46.173 25.305 20.098 1.00 0.00 H ATOM 131 HE21 GLN A 822 -45.840 27.069 20.241 1.00 0.00 H ATOM 132 H GLN A 822 -40.635 23.632 18.733 1.00 0.00 H ATOM 133 N ALA A 823 -43.011 21.726 20.163 1.00 11.79 N ATOM 134 CA ALA A 823 -43.711 20.655 20.873 1.00 11.41 C ATOM 135 C ALA A 823 -43.517 20.777 22.391 1.00 11.58 C ATOM 136 O ALA A 823 -44.434 20.502 23.157 1.00 13.01 O ATOM 137 CB ALA A 823 -43.239 19.283 20.381 1.00 12.60 C ATOM 138 H ALA A 823 -42.245 21.497 19.498 1.00 0.00 H ATOM 139 N LEU A 824 -42.323 21.189 22.806 1.00 11.10 N ATOM 140 CA LEU A 824 -42.038 21.402 24.227 1.00 11.35 C ATOM 141 C LEU A 824 -42.801 22.618 24.762 1.00 12.40 C ATOM 142 O LEU A 824 -43.295 22.594 25.887 1.00 13.70 O ATOM 143 CB LEU A 824 -40.526 21.572 24.454 1.00 11.31 C ATOM 144 CG LEU A 824 -39.700 20.297 24.217 1.00 10.73 C ATOM 145 CD1 LEU A 824 -38.204 20.608 24.211 1.00 14.88 C ATOM 146 CD2 LEU A 824 -40.018 19.230 25.260 1.00 13.53 C ATOM 147 H LEU A 824 -41.574 21.364 22.106 1.00 0.00 H ATOM 148 N ILE A 825 -42.894 23.679 23.964 1.00 11.86 N ATOM 149 CA ILE A 825 -43.677 24.854 24.368 1.00 13.44 C ATOM 150 C ILE A 825 -45.124 24.437 24.594 1.00 14.67 C ATOM 151 O ILE A 825 -45.707 24.730 25.633 1.00 14.87 O ATOM 152 CB ILE A 825 -43.612 25.972 23.323 1.00 15.49 C ATOM 153 CG1 ILE A 825 -42.204 26.581 23.302 1.00 15.49 C ATOM 154 CG2 ILE A 825 -44.668 27.052 23.612 1.00 17.53 C ATOM 155 CD1 ILE A 825 -41.949 27.549 22.138 1.00 15.84 C ATOM 156 H ILE A 825 -42.407 23.676 23.045 1.00 0.00 H ATOM 157 N ASP A 826 -45.689 23.710 23.635 1.00 14.53 N ATOM 158 CA ASP A 826 -47.082 23.281 23.744 1.00 14.19 C ATOM 159 C ASP A 826 -47.306 22.417 24.984 1.00 13.61 C ATOM 160 O ASP A 826 -48.274 22.613 25.719 1.00 16.16 O ATOM 161 CB ASP A 826 -47.514 22.509 22.493 1.00 16.81 C ATOM 162 CG ASP A 826 -47.483 23.358 21.225 1.00 23.49 C ATOM 163 OD1 ASP A 826 -47.402 24.603 21.317 1.00 23.52 O ATOM 164 OD2 ASP A 826 -47.551 22.761 20.128 1.00 25.74 O ATOM 165 H ASP A 826 -45.133 23.443 22.797 1.00 0.00 H ATOM 166 N SER A 827 -46.410 21.463 25.224 1.00 11.58 N ATOM 167 CA SER A 827 -46.603 20.533 26.331 1.00 11.10 C ATOM 168 C SER A 827 -46.427 21.210 27.689 1.00 13.30 C ATOM 169 O SER A 827 -47.173 20.924 28.632 1.00 12.76 O ATOM 170 CB SER A 827 -45.643 19.346 26.212 1.00 11.98 C ATOM 171 OG SER A 827 -44.303 19.736 26.442 1.00 13.44 O ATOM 172 HG SER A 827 -44.040 20.419 25.776 1.00 0.00 H ATOM 173 H SER A 827 -45.568 21.380 24.619 1.00 0.00 H ATOM 174 N THR A 828 -45.452 22.107 27.791 1.00 12.48 N ATOM 175 CA THR A 828 -45.135 22.707 29.086 1.00 14.52 C ATOM 176 C THR A 828 -46.152 23.760 29.481 1.00 16.79 C ATOM 177 O THR A 828 -46.132 24.240 30.623 1.00 18.74 O ATOM 178 CB THR A 828 -43.707 23.333 29.129 1.00 12.80 C ATOM 179 OG1 THR A 828 -43.568 24.333 28.111 1.00 16.74 O ATOM 180 CG2 THR A 828 -42.624 22.260 28.974 1.00 15.99 C ATOM 181 HG1 THR A 828 -43.713 23.920 27.223 1.00 0.00 H ATOM 182 H THR A 828 -44.912 22.383 26.946 1.00 0.00 H ATOM 183 N ARG A 829 -47.057 24.102 28.569 1.00 14.89 N ATOM 184 CA ARG A 829 -48.106 25.066 28.880 1.00 19.40 C ATOM 185 C ARG A 829 -49.418 24.410 29.306 1.00 16.80 C ATOM 186 O ARG A 829 -50.353 25.108 29.714 1.00 19.08 O ATOM 187 CB ARG A 829 -48.335 25.984 27.686 1.00 22.05 C ATOM 188 CG ARG A 829 -47.146 26.884 27.475 1.00 28.52 C ATOM 189 CD ARG A 829 -47.387 27.973 26.464 1.00 34.58 C ATOM 190 NE ARG A 829 -46.447 29.057 26.715 1.00 41.88 N ATOM 191 CZ ARG A 829 -46.280 30.107 25.925 1.00 45.23 C ATOM 192 NH1 ARG A 829 -46.994 30.225 24.811 1.00 46.92 N ATOM 193 NH2 ARG A 829 -45.394 31.037 26.254 1.00 48.59 N ATOM 194 HE ARG A 829 -45.866 29.003 27.576 1.00 0.00 H ATOM 195 HH12 ARG A 829 -46.861 31.051 24.193 1.00 0.00 H ATOM 196 HH11 ARG A 829 -47.686 29.492 24.557 1.00 0.00 H ATOM 197 HH22 ARG A 829 -45.256 31.865 25.640 1.00 0.00 H ATOM 198 HH21 ARG A 829 -44.837 30.939 27.127 1.00 0.00 H ATOM 199 H ARG A 829 -47.016 23.676 27.621 1.00 0.00 H ATOM 200 N GLU A 830 -49.494 23.084 29.206 1.00 14.43 N ATOM 201 CA GLU A 830 -50.646 22.348 29.715 1.00 14.83 C ATOM 202 C GLU A 830 -50.666 22.470 31.229 1.00 11.84 C ATOM 203 O GLU A 830 -49.610 22.478 31.859 1.00 12.43 O ATOM 204 CB GLU A 830 -50.599 20.881 29.294 1.00 16.58 C ATOM 205 CG GLU A 830 -50.719 20.668 27.788 1.00 20.23 C ATOM 206 CD GLU A 830 -52.101 20.996 27.251 1.00 29.73 C ATOM 207 OE1 GLU A 830 -53.081 20.906 28.021 1.00 31.03 O ATOM 208 OE2 GLU A 830 -52.208 21.342 26.054 1.00 36.22 O ATOM 209 H GLU A 830 -48.715 22.562 28.755 1.00 0.00 H ATOM 210 N PRO A 831 -51.867 22.571 31.819 1.00 13.26 N ATOM 211 CA PRO A 831 -51.996 22.825 33.263 1.00 11.93 C ATOM 212 C PRO A 831 -51.172 21.896 34.151 1.00 12.41 C ATOM 213 O PRO A 831 -50.586 22.361 35.131 1.00 12.75 O ATOM 214 CB PRO A 831 -53.491 22.627 33.517 1.00 15.22 C ATOM 215 CG PRO A 831 -54.125 23.014 32.226 1.00 17.92 C ATOM 216 CD PRO A 831 -53.177 22.533 31.151 1.00 14.35 C ATOM 217 N ASN A 832 -51.100 20.609 33.818 1.00 11.40 N ATOM 218 CA ASN A 832 -50.399 19.671 34.691 1.00 11.80 C ATOM 219 C ASN A 832 -48.910 19.557 34.416 1.00 12.60 C ATOM 220 O ASN A 832 -48.222 18.723 35.021 1.00 13.23 O ATOM 221 CB ASN A 832 -51.055 18.293 34.605 1.00 11.53 C ATOM 222 CG ASN A 832 -52.449 18.293 35.190 1.00 17.28 C ATOM 223 OD1 ASN A 832 -52.795 19.156 36.003 1.00 17.25 O ATOM 224 ND2 ASN A 832 -53.265 17.327 34.780 1.00 22.01 N ATOM 225 HD22 ASN A 832 -52.931 16.621 34.094 1.00 0.00 H ATOM 226 HD21 ASN A 832 -54.237 17.278 35.146 1.00 0.00 H ATOM 227 H ASN A 832 -51.542 20.272 32.939 1.00 0.00 H ATOM 228 N SER A 833 -48.394 20.425 33.550 1.00 10.60 N ATOM 229 CA SER A 833 -46.960 20.417 33.289 1.00 9.67 C ATOM 230 C SER A 833 -46.124 20.729 34.518 1.00 9.74 C ATOM 231 O SER A 833 -46.374 21.719 35.222 1.00 12.74 O ATOM 232 CB SER A 833 -46.594 21.422 32.206 1.00 11.83 C ATOM 233 OG SER A 833 -45.176 21.416 32.040 1.00 11.42 O ATOM 234 HG SER A 833 -44.880 20.510 31.774 1.00 0.00 H ATOM 235 H SER A 833 -49.010 21.106 33.062 1.00 0.00 H ATOM 236 N SER A 834 -45.125 19.885 34.767 1.00 9.32 N ATOM 237 CA SER A 834 -44.170 20.111 35.854 1.00 9.92 C ATOM 238 C SER A 834 -42.991 20.975 35.427 1.00 10.38 C ATOM 239 O SER A 834 -42.108 21.270 36.236 1.00 12.47 O ATOM 240 CB SER A 834 -43.646 18.777 36.390 1.00 12.24 C ATOM 241 OG SER A 834 -44.670 18.046 37.041 1.00 13.78 O ATOM 242 HG SER A 834 -45.020 18.576 37.801 1.00 0.00 H ATOM 243 H SER A 834 -45.020 19.039 34.171 1.00 0.00 H ATOM 244 N ALA A 835 -42.978 21.365 34.158 1.00 10.50 N ATOM 245 CA ALA A 835 -41.869 22.121 33.583 1.00 10.18 C ATOM 246 C ALA A 835 -42.367 23.444 33.016 1.00 9.70 C ATOM 247 O ALA A 835 -43.458 23.521 32.454 1.00 12.25 O ATOM 248 CB ALA A 835 -41.184 21.311 32.479 1.00 11.82 C ATOM 249 H ALA A 835 -43.787 21.123 33.551 1.00 0.00 H ATOM 250 N GLN A 836 -41.554 24.477 33.165 1.00 10.03 N ATOM 251 CA GLN A 836 -41.806 25.763 32.514 1.00 10.64 C ATOM 252 C GLN A 836 -40.561 26.134 31.724 1.00 13.82 C ATOM 253 O GLN A 836 -39.444 25.974 32.216 1.00 12.99 O ATOM 254 CB GLN A 836 -42.145 26.852 33.535 1.00 11.37 C ATOM 255 CG GLN A 836 -41.065 27.073 34.604 1.00 11.47 C ATOM 256 CD GLN A 836 -41.335 28.301 35.455 1.00 13.87 C ATOM 257 OE1 GLN A 836 -41.410 29.423 34.946 1.00 14.16 O ATOM 258 NE2 GLN A 836 -41.489 28.098 36.764 1.00 14.26 N ATOM 259 HE22 GLN A 836 -41.418 27.136 37.153 1.00 0.00 H ATOM 260 HE21 GLN A 836 -41.680 28.902 37.396 1.00 0.00 H ATOM 261 H GLN A 836 -40.710 24.372 33.763 1.00 0.00 H ATOM 262 N ILE A 837 -40.744 26.616 30.497 1.00 11.97 N ATOM 263 CA ILE A 837 -39.602 27.047 29.702 1.00 13.65 C ATOM 264 C ILE A 837 -39.361 28.531 29.950 1.00 14.37 C ATOM 265 O ILE A 837 -40.217 29.368 29.646 1.00 15.37 O ATOM 266 CB ILE A 837 -39.816 26.794 28.202 1.00 13.07 C ATOM 267 CG1 ILE A 837 -40.006 25.295 27.945 1.00 13.26 C ATOM 268 CG2 ILE A 837 -38.639 27.327 27.402 1.00 14.49 C ATOM 269 CD1 ILE A 837 -40.490 24.975 26.550 1.00 15.48 C ATOM 270 H ILE A 837 -41.705 26.685 30.105 1.00 0.00 H ATOM 271 N ASP A 838 -38.195 28.854 30.502 1.00 13.86 N ATOM 272 CA ASP A 838 -37.895 30.226 30.907 1.00 15.03 C ATOM 273 C ASP A 838 -36.903 30.940 30.009 1.00 16.13 C ATOM 274 O ASP A 838 -36.769 32.162 30.086 1.00 18.26 O ATOM 275 CB ASP A 838 -37.376 30.231 32.341 1.00 15.79 C ATOM 276 CG ASP A 838 -38.405 29.698 33.298 1.00 17.23 C ATOM 277 OD1 ASP A 838 -39.522 30.246 33.275 1.00 16.95 O ATOM 278 OD2 ASP A 838 -38.135 28.700 34.001 1.00 15.59 O ATOM 279 H ASP A 838 -37.480 28.113 30.649 1.00 0.00 H ATOM 280 N ILE A 839 -36.201 30.185 29.174 1.00 15.78 N ATOM 281 CA ILE A 839 -35.233 30.788 28.263 1.00 16.87 C ATOM 282 C ILE A 839 -34.962 29.854 27.091 1.00 16.57 C ATOM 283 O ILE A 839 -34.894 28.637 27.256 1.00 15.45 O ATOM 284 CB ILE A 839 -33.902 31.140 28.997 1.00 17.21 C ATOM 285 CG1 ILE A 839 -32.934 31.914 28.093 1.00 21.33 C ATOM 286 CG2 ILE A 839 -33.241 29.896 29.568 1.00 16.57 C ATOM 287 CD1 ILE A 839 -33.434 33.284 27.699 1.00 22.68 C ATOM 288 H ILE A 839 -36.342 29.155 29.168 1.00 0.00 H ATOM 289 N VAL A 840 -34.846 30.436 25.899 1.00 17.66 N ATOM 290 CA VAL A 840 -34.435 29.694 24.711 1.00 17.70 C ATOM 291 C VAL A 840 -33.109 30.279 24.249 1.00 18.77 C ATOM 292 O VAL A 840 -32.984 31.487 24.070 1.00 20.00 O ATOM 293 CB VAL A 840 -35.490 29.773 23.586 1.00 18.21 C ATOM 294 CG1 VAL A 840 -34.925 29.236 22.267 1.00 18.65 C ATOM 295 CG2 VAL A 840 -36.739 29.001 23.994 1.00 17.16 C ATOM 296 H VAL A 840 -35.055 31.451 25.812 1.00 0.00 H ATOM 297 N ILE A 841 -32.114 29.417 24.093 1.00 18.42 N ATOM 298 CA ILE A 841 -30.785 29.842 23.662 1.00 19.53 C ATOM 299 C ILE A 841 -30.443 29.216 22.320 1.00 20.04 C ATOM 300 O ILE A 841 -30.529 27.998 22.163 1.00 20.97 O ATOM 301 CB ILE A 841 -29.711 29.446 24.694 1.00 19.04 C ATOM 302 CG1 ILE A 841 -29.996 30.116 26.039 1.00 21.20 C ATOM 303 CG2 ILE A 841 -28.324 29.797 24.193 1.00 21.81 C ATOM 304 CD1 ILE A 841 -29.163 29.590 27.181 1.00 19.41 C ATOM 305 H ILE A 841 -32.285 28.409 24.283 1.00 0.00 H ATOM 306 N SER A 842 -30.076 30.047 21.349 1.00 21.28 N ATOM 307 CA SER A 842 -29.598 29.547 20.067 1.00 23.69 C ATOM 308 C SER A 842 -28.131 29.888 19.890 1.00 24.25 C ATOM 309 O SER A 842 -27.693 30.960 20.299 1.00 24.51 O ATOM 310 CB SER A 842 -30.404 30.141 18.909 1.00 24.08 C ATOM 311 OG SER A 842 -29.920 29.654 17.667 1.00 25.99 O ATOM 312 HG SER A 842 -30.451 30.047 16.930 1.00 0.00 H ATOM 313 H SER A 842 -30.131 31.073 21.508 1.00 0.00 H ATOM 314 N ASN A 843 -27.367 28.991 19.275 1.00 24.84 N ATOM 315 CA ASN A 843 -25.998 29.336 18.902 1.00 26.38 C ATOM 316 C ASN A 843 -25.945 29.966 17.510 1.00 27.80 C ATOM 317 O ASN A 843 -24.869 30.296 17.009 1.00 28.40 O ATOM 318 CB ASN A 843 -25.075 28.114 18.961 1.00 27.86 C ATOM 319 CG ASN A 843 -25.426 27.062 17.927 1.00 28.99 C ATOM 320 OD1 ASN A 843 -26.573 26.625 17.834 1.00 28.33 O ATOM 321 ND2 ASN A 843 -24.433 26.651 17.134 1.00 27.92 N ATOM 322 HD22 ASN A 843 -23.478 27.048 17.248 1.00 0.00 H ATOM 323 HD21 ASN A 843 -24.614 25.934 16.403 1.00 0.00 H ATOM 324 H ASN A 843 -27.743 28.046 19.060 1.00 0.00 H ATOM 325 N LYS A 844 -27.112 30.141 16.893 1.00 27.04 N ATOM 326 CA LYS A 844 -27.195 30.730 15.559 1.00 29.37 C ATOM 327 C LYS A 844 -28.280 31.799 15.470 1.00 30.46 C ATOM 328 O LYS A 844 -29.403 31.606 15.936 1.00 29.91 O ATOM 329 CB LYS A 844 -27.447 29.647 14.508 1.00 33.84 C ATOM 330 CG LYS A 844 -26.278 28.706 14.308 1.00 42.04 C ATOM 331 CD LYS A 844 -26.573 27.661 13.250 1.00 47.63 C ATOM 332 CE LYS A 844 -25.351 26.793 13.000 1.00 53.70 C ATOM 333 NZ LYS A 844 -25.663 25.642 12.104 1.00 57.23 N ATOM 334 HZ1 LYS A 844 -26.399 25.052 12.543 1.00 0.00 H ATOM 335 HZ2 LYS A 844 -26.003 25.999 11.188 1.00 0.00 H ATOM 336 HZ3 LYS A 844 -24.804 25.075 11.958 1.00 0.00 H ATOM 337 H LYS A 844 -27.987 29.851 17.374 1.00 0.00 H ATOM 338 N ALA A 845 -27.936 32.929 14.857 1.00 34.14 N ATOM 339 CA ALA A 845 -28.883 34.020 14.682 1.00 32.82 C ATOM 340 C ALA A 845 -29.885 33.705 13.577 1.00 31.40 C ATOM 341 O ALA A 845 -29.600 32.912 12.677 1.00 36.13 O ATOM 342 CB ALA A 845 -28.143 35.319 14.368 1.00 37.25 C ATOM 343 H ALA A 845 -26.967 33.035 14.494 1.00 0.00 H ATOM 344 N ALA A 846 -31.062 34.318 13.667 1.00 33.09 N ATOM 345 CA ALA A 846 -32.044 34.308 12.583 1.00 36.69 C ATOM 346 C ALA A 846 -32.508 32.913 12.188 1.00 37.32 C ATOM 347 O ALA A 846 -32.730 32.641 11.004 1.00 36.76 O ATOM 348 CB ALA A 846 -31.480 35.022 11.361 1.00 41.56 C ATOM 349 H ALA A 846 -31.294 34.826 14.545 1.00 0.00 H ATOM 350 N VAL A 847 -32.643 32.024 13.167 1.00 35.00 N ATOM 351 CA VAL A 847 -33.210 30.715 12.886 1.00 32.65 C ATOM 352 C VAL A 847 -34.676 30.734 13.294 1.00 26.88 C ATOM 353 O VAL A 847 -35.077 31.534 14.137 1.00 28.61 O ATOM 354 CB VAL A 847 -32.452 29.581 13.606 1.00 31.00 C ATOM 355 CG1 VAL A 847 -31.031 29.482 13.069 1.00 31.92 C ATOM 356 CG2 VAL A 847 -32.466 29.778 15.116 1.00 30.69 C ATOM 357 H VAL A 847 -32.343 32.265 14.133 1.00 0.00 H ATOM 358 N ALA A 848 -35.472 29.862 12.681 1.00 28.41 N ATOM 359 CA ALA A 848 -36.919 29.870 12.883 1.00 28.33 C ATOM 360 C ALA A 848 -37.326 29.572 14.323 1.00 28.52 C ATOM 361 O ALA A 848 -38.372 30.036 14.781 1.00 26.28 O ATOM 362 CB ALA A 848 -37.582 28.883 11.939 1.00 26.61 C ATOM 363 H ALA A 848 -35.054 29.157 12.042 1.00 0.00 H ATOM 364 N GLY A 849 -36.510 28.794 15.034 1.00 25.29 N ATOM 365 CA GLY A 849 -36.790 28.470 16.421 1.00 24.69 C ATOM 366 C GLY A 849 -36.902 29.708 17.298 1.00 23.24 C ATOM 367 O GLY A 849 -37.666 29.720 18.261 1.00 23.16 O ATOM 368 H GLY A 849 -35.654 28.411 14.585 1.00 0.00 H ATOM 369 N LEU A 850 -36.138 30.746 16.970 1.00 24.94 N ATOM 370 CA LEU A 850 -36.198 31.995 17.729 1.00 24.96 C ATOM 371 C LEU A 850 -37.537 32.700 17.522 1.00 28.72 C ATOM 372 O LEU A 850 -38.099 33.258 18.462 1.00 28.86 O ATOM 373 CB LEU A 850 -35.050 32.927 17.339 1.00 27.91 C ATOM 374 CG LEU A 850 -33.627 32.507 17.718 1.00 26.72 C ATOM 375 CD1 LEU A 850 -32.614 33.439 17.072 1.00 27.86 C ATOM 376 CD2 LEU A 850 -33.441 32.483 19.226 1.00 25.44 C ATOM 377 H LEU A 850 -35.488 30.669 16.162 1.00 0.00 H ATOM 378 N ASP A 851 -38.037 32.674 16.291 1.00 30.56 N ATOM 379 CA ASP A 851 -39.364 33.209 15.992 1.00 33.93 C ATOM 380 C ASP A 851 -40.430 32.494 16.818 1.00 29.78 C ATOM 381 O ASP A 851 -41.349 33.117 17.342 1.00 30.93 O ATOM 382 CB ASP A 851 -39.692 33.067 14.504 1.00 36.73 C ATOM 383 CG ASP A 851 -38.683 33.760 13.610 1.00 43.34 C ATOM 384 OD1 ASP A 851 -38.040 34.727 14.073 1.00 44.63 O ATOM 385 OD2 ASP A 851 -38.540 33.339 12.440 1.00 46.49 O ATOM 386 H ASP A 851 -37.470 32.263 15.522 1.00 0.00 H ATOM 387 N LYS A 852 -40.305 31.176 16.926 1.00 26.23 N ATOM 388 CA LYS A 852 -41.284 30.392 17.654 1.00 23.59 C ATOM 389 C LYS A 852 -41.274 30.761 19.137 1.00 26.31 C ATOM 390 O LYS A 852 -42.327 30.859 19.774 1.00 26.80 O ATOM 391 CB LYS A 852 -41.011 28.892 17.468 1.00 21.91 C ATOM 392 CG LYS A 852 -41.220 28.395 16.040 1.00 24.41 C ATOM 393 CD LYS A 852 -40.886 26.902 15.917 1.00 23.42 C ATOM 394 CE LYS A 852 -41.223 26.354 14.539 1.00 26.92 C ATOM 395 NZ LYS A 852 -40.460 27.016 13.442 1.00 29.28 N ATOM 396 HZ1 LYS A 852 -40.674 28.034 13.437 1.00 0.00 H ATOM 397 HZ2 LYS A 852 -39.441 26.876 13.596 1.00 0.00 H ATOM 398 HZ3 LYS A 852 -40.734 26.599 12.530 1.00 0.00 H ATOM 399 H LYS A 852 -39.494 30.700 16.482 1.00 0.00 H ATOM 400 N ALA A 853 -40.083 30.969 19.688 1.00 23.11 N ATOM 401 CA ALA A 853 -39.969 31.345 21.091 1.00 23.66 C ATOM 402 C ALA A 853 -40.554 32.739 21.323 1.00 27.35 C ATOM 403 O ALA A 853 -41.286 32.954 22.291 1.00 26.44 O ATOM 404 CB ALA A 853 -38.517 31.290 21.545 1.00 24.16 C ATOM 405 H ALA A 853 -39.224 30.862 19.112 1.00 0.00 H ATOM 406 N GLU A 854 -40.234 33.672 20.429 1.00 28.58 N ATOM 407 CA GLU A 854 -40.740 35.046 20.534 1.00 29.29 C ATOM 408 C GLU A 854 -42.261 35.063 20.475 1.00 33.25 C ATOM 409 O GLU A 854 -42.918 35.740 21.271 1.00 33.19 O ATOM 410 CB GLU A 854 -40.164 35.935 19.427 1.00 35.66 C ATOM 411 CG GLU A 854 -38.653 36.122 19.483 1.00 39.21 C ATOM 412 CD GLU A 854 -38.101 36.813 18.247 1.00 42.45 C ATOM 413 OE1 GLU A 854 -38.900 37.333 17.437 1.00 44.25 O ATOM 414 OE2 GLU A 854 -36.862 36.831 18.084 1.00 44.27 O ATOM 415 H GLU A 854 -39.610 33.421 19.636 1.00 0.00 H ATOM 416 N ARG A 855 -42.818 34.301 19.538 1.00 33.42 N ATOM 417 CA ARG A 855 -44.266 34.230 19.375 1.00 36.10 C ATOM 418 C ARG A 855 -44.925 33.695 20.644 1.00 37.29 C ATOM 419 O ARG A 855 -46.045 34.075 20.979 1.00 36.64 O ATOM 420 CB ARG A 855 -44.624 33.355 18.170 1.00 41.04 C ATOM 421 CG ARG A 855 -46.100 33.337 17.818 1.00 48.33 C ATOM 422 CD ARG A 855 -46.379 32.411 16.640 1.00 54.98 C ATOM 423 NE ARG A 855 -47.808 32.324 16.340 1.00 60.71 N ATOM 424 CZ ARG A 855 -48.321 31.657 15.309 1.00 64.45 C ATOM 425 NH1 ARG A 855 -47.523 31.008 14.468 1.00 65.70 N ATOM 426 NH2 ARG A 855 -49.634 31.637 15.117 1.00 64.43 N ATOM 427 HE ARG A 855 -48.468 32.817 16.975 1.00 0.00 H ATOM 428 HH12 ARG A 855 -47.928 30.488 13.664 1.00 0.00 H ATOM 429 HH11 ARG A 855 -46.493 31.020 14.614 1.00 0.00 H ATOM 430 HH22 ARG A 855 -50.034 31.115 14.311 1.00 0.00 H ATOM 431 HH21 ARG A 855 -50.263 32.143 15.773 1.00 0.00 H ATOM 432 H ARG A 855 -42.208 33.743 18.907 1.00 0.00 H ATOM 433 N ALA A 856 -44.214 32.824 21.357 1.00 29.47 N ATOM 434 CA ALA A 856 -44.726 32.235 22.588 1.00 27.97 C ATOM 435 C ALA A 856 -44.431 33.088 23.823 1.00 29.07 C ATOM 436 O ALA A 856 -44.786 32.714 24.939 1.00 29.61 O ATOM 437 CB ALA A 856 -44.150 30.826 22.773 1.00 27.04 C ATOM 438 H ALA A 856 -43.265 32.556 21.026 1.00 0.00 H ATOM 439 N GLY A 857 -43.777 34.229 23.629 1.00 27.10 N ATOM 440 CA GLY A 857 -43.480 35.125 24.733 1.00 27.61 C ATOM 441 C GLY A 857 -42.377 34.631 25.650 1.00 27.39 C ATOM 442 O GLY A 857 -42.331 34.985 26.828 1.00 29.17 O ATOM 443 H GLY A 857 -43.472 34.485 22.668 1.00 0.00 H ATOM 444 N ILE A 858 -41.485 33.809 25.106 1.00 24.75 N ATOM 445 CA ILE A 858 -40.350 33.293 25.864 1.00 22.90 C ATOM 446 C ILE A 858 -39.080 34.062 25.503 1.00 23.19 C ATOM 447 O ILE A 858 -38.786 34.253 24.320 1.00 26.08 O ATOM 448 CB ILE A 858 -40.136 31.777 25.597 1.00 19.09 C ATOM 449 CG1 ILE A 858 -41.371 30.966 26.007 1.00 19.73 C ATOM 450 CG2 ILE A 858 -38.902 31.269 26.330 1.00 21.14 C ATOM 451 CD1 ILE A 858 -41.353 29.538 25.485 1.00 18.21 C ATOM 452 H ILE A 858 -41.599 33.526 24.112 1.00 0.00 H ATOM 453 N PRO A 859 -38.323 34.519 26.520 1.00 22.04 N ATOM 454 CA PRO A 859 -37.045 35.203 26.297 1.00 26.53 C ATOM 455 C PRO A 859 -36.087 34.368 25.452 1.00 26.11 C ATOM 456 O PRO A 859 -36.087 33.144 25.575 1.00 21.89 O ATOM 457 CB PRO A 859 -36.486 35.380 27.712 1.00 26.76 C ATOM 458 CG PRO A 859 -37.668 35.367 28.593 1.00 28.19 C ATOM 459 CD PRO A 859 -38.670 34.454 27.950 1.00 24.67 C ATOM 460 N THR A 860 -35.289 35.026 24.615 1.00 25.16 N ATOM 461 CA THR A 860 -34.281 34.344 23.812 1.00 23.72 C ATOM 462 C THR A 860 -32.910 34.986 23.955 1.00 26.03 C ATOM 463 O THR A 860 -32.792 36.194 24.194 1.00 29.01 O ATOM 464 CB THR A 860 -34.633 34.351 22.312 1.00 25.04 C ATOM 465 OG1 THR A 860 -34.742 35.710 21.866 1.00 28.73 O ATOM 466 CG2 THR A 860 -35.938 33.647 22.056 1.00 25.50 C ATOM 467 HG1 THR A 860 -33.879 36.173 22.010 1.00 0.00 H ATOM 468 H THR A 860 -35.387 36.058 24.531 1.00 0.00 H ATOM 469 N ARG A 861 -31.871 34.172 23.802 1.00 24.44 N ATOM 470 CA ARG A 861 -30.502 34.667 23.726 1.00 26.55 C ATOM 471 C ARG A 861 -29.782 33.981 22.578 1.00 27.17 C ATOM 472 O ARG A 861 -29.936 32.778 22.378 1.00 26.55 O ATOM 473 CB ARG A 861 -29.743 34.421 25.031 1.00 27.75 C ATOM 474 CG ARG A 861 -30.280 35.160 26.241 1.00 27.77 C ATOM 475 CD ARG A 861 -29.929 36.638 26.212 1.00 29.42 C ATOM 476 NE ARG A 861 -30.090 37.235 27.535 1.00 30.06 N ATOM 477 CZ ARG A 861 -31.257 37.620 28.042 1.00 32.16 C ATOM 478 NH1 ARG A 861 -31.315 38.146 29.257 1.00 33.84 N ATOM 479 NH2 ARG A 861 -32.370 37.476 27.334 1.00 30.54 N ATOM 480 HE ARG A 861 -29.238 37.367 28.117 1.00 0.00 H ATOM 481 HH12 ARG A 861 -32.230 38.446 29.651 1.00 0.00 H ATOM 482 HH11 ARG A 861 -30.446 38.259 29.817 1.00 0.00 H ATOM 483 HH22 ARG A 861 -33.282 37.778 27.732 1.00 0.00 H ATOM 484 HH21 ARG A 861 -32.330 37.061 26.381 1.00 0.00 H ATOM 485 H ARG A 861 -32.040 33.148 23.734 1.00 0.00 H ATOM 486 N VAL A 862 -29.004 34.745 21.818 1.00 27.97 N ATOM 487 CA VAL A 862 -28.143 34.153 20.810 1.00 31.70 C ATOM 488 C VAL A 862 -26.711 34.191 21.321 1.00 29.80 C ATOM 489 O VAL A 862 -26.170 35.262 21.610 1.00 32.31 O ATOM 490 CB VAL A 862 -28.232 34.868 19.447 1.00 30.40 C ATOM 491 CG1 VAL A 862 -27.152 34.343 18.509 1.00 33.60 C ATOM 492 CG2 VAL A 862 -29.604 34.666 18.837 1.00 31.20 C ATOM 493 H VAL A 862 -29.012 35.777 21.947 1.00 0.00 H ATOM 494 N ILE A 863 -26.114 33.012 21.451 1.00 29.15 N ATOM 495 CA ILE A 863 -24.711 32.892 21.814 1.00 31.44 C ATOM 496 C ILE A 863 -23.957 32.216 20.676 1.00 33.67 C ATOM 497 O ILE A 863 -23.963 30.992 20.550 1.00 31.04 O ATOM 498 CB ILE A 863 -24.521 32.100 23.122 1.00 31.88 C ATOM 499 CG1 ILE A 863 -25.397 32.695 24.228 1.00 31.80 C ATOM 500 CG2 ILE A 863 -23.048 32.080 23.525 1.00 29.79 C ATOM 501 CD1 ILE A 863 -25.373 31.915 25.528 1.00 31.70 C ATOM 502 H ILE A 863 -26.668 32.147 21.288 1.00 0.00 H ATOM 503 N ASN A 864 -23.321 33.035 19.846 1.00 32.94 N ATOM 504 CA ASN A 864 -22.591 32.571 18.670 1.00 36.69 C ATOM 505 C ASN A 864 -21.286 31.871 19.032 1.00 36.43 C ATOM 506 O ASN A 864 -20.348 32.512 19.502 1.00 35.69 O ATOM 507 CB ASN A 864 -22.298 33.759 17.747 1.00 39.05 C ATOM 508 CG ASN A 864 -21.857 33.331 16.362 1.00 41.39 C ATOM 509 OD1 ASN A 864 -21.510 32.172 16.134 1.00 42.20 O ATOM 510 ND2 ASN A 864 -21.849 34.279 15.428 1.00 45.04 N ATOM 511 HD22 ASN A 864 -22.151 35.246 15.665 1.00 0.00 H ATOM 512 HD21 ASN A 864 -21.541 34.053 14.461 1.00 0.00 H ATOM 513 H ASN A 864 -23.344 34.056 20.043 1.00 0.00 H ATOM 514 N HIS A 865 -21.211 30.565 18.789 1.00 33.55 N ATOM 515 CA HIS A 865 -20.017 29.801 19.146 1.00 33.81 C ATOM 516 C HIS A 865 -18.784 30.280 18.380 1.00 37.17 C ATOM 517 O HIS A 865 -17.655 30.121 18.846 1.00 36.81 O ATOM 518 CB HIS A 865 -20.236 28.303 18.905 1.00 32.47 C ATOM 519 CG HIS A 865 -20.435 27.940 17.466 1.00 33.10 C ATOM 520 ND1 HIS A 865 -21.678 27.892 16.874 1.00 32.30 N ATOM 521 CD2 HIS A 865 -19.544 27.613 16.499 1.00 37.81 C ATOM 522 CE1 HIS A 865 -21.547 27.544 15.605 1.00 33.20 C ATOM 523 NE2 HIS A 865 -20.262 27.370 15.352 1.00 39.34 N ATOM 524 H HIS A 865 -22.014 30.081 18.339 1.00 0.00 H ATOM 525 N LYS A 866 -19.010 30.877 17.214 1.00 37.38 N ATOM 526 CA LYS A 866 -17.919 31.358 16.367 1.00 44.92 C ATOM 527 C LYS A 866 -17.118 32.476 17.028 1.00 46.37 C ATOM 528 O LYS A 866 -15.972 32.734 16.654 1.00 48.86 O ATOM 529 CB LYS A 866 -18.462 31.854 15.027 1.00 47.68 C ATOM 530 CG LYS A 866 -19.104 30.784 14.161 1.00 50.11 C ATOM 531 CD LYS A 866 -19.710 31.412 12.916 1.00 54.81 C ATOM 532 CE LYS A 866 -20.390 30.378 12.038 1.00 57.91 C ATOM 533 NZ LYS A 866 -21.083 31.019 10.882 1.00 61.60 N ATOM 534 HZ1 LYS A 866 -21.804 31.680 11.235 1.00 0.00 H ATOM 535 HZ2 LYS A 866 -20.388 31.537 10.307 1.00 0.00 H ATOM 536 HZ3 LYS A 866 -21.538 30.285 10.302 1.00 0.00 H ATOM 537 H LYS A 866 -19.991 31.006 16.895 1.00 0.00 H ATOM 538 N LEU A 867 -17.726 33.143 18.004 1.00 43.00 N ATOM 539 CA LEU A 867 -17.109 34.304 18.637 1.00 45.86 C ATOM 540 C LEU A 867 -16.236 33.930 19.830 1.00 45.79 C ATOM 541 O LEU A 867 -15.661 34.802 20.478 1.00 48.63 O ATOM 542 CB LEU A 867 -18.189 35.294 19.077 1.00 44.19 C ATOM 543 CG LEU A 867 -19.043 35.870 17.945 1.00 46.93 C ATOM 544 CD1 LEU A 867 -20.187 36.708 18.487 1.00 46.72 C ATOM 545 CD2 LEU A 867 -18.173 36.697 17.007 1.00 49.89 C ATOM 546 H LEU A 867 -18.665 32.830 18.324 1.00 0.00 H ATOM 547 N TYR A 868 -16.131 32.634 20.114 1.00 40.14 N ATOM 548 CA TYR A 868 -15.395 32.176 21.290 1.00 40.06 C ATOM 549 C TYR A 868 -14.134 31.412 20.902 1.00 44.98 C ATOM 550 O TYR A 868 -14.100 30.734 19.875 1.00 45.59 O ATOM 551 CB TYR A 868 -16.310 31.325 22.183 1.00 37.11 C ATOM 552 CG TYR A 868 -17.397 32.167 22.809 1.00 36.05 C ATOM 553 CD1 TYR A 868 -18.596 32.401 22.143 1.00 35.47 C ATOM 554 CD2 TYR A 868 -17.205 32.770 24.044 1.00 36.00 C ATOM 555 CE1 TYR A 868 -19.582 33.192 22.703 1.00 34.82 C ATOM 556 CE2 TYR A 868 -18.181 33.565 24.611 1.00 35.37 C ATOM 557 CZ TYR A 868 -19.365 33.774 23.937 1.00 34.78 C ATOM 558 OH TYR A 868 -20.330 34.569 24.505 1.00 38.12 O ATOM 559 HH TYR A 868 -19.965 35.478 24.649 1.00 0.00 H ATOM 560 H TYR A 868 -16.580 31.935 19.488 1.00 0.00 H ATOM 561 N LYS A 869 -13.097 31.547 21.724 1.00 45.84 N ATOM 562 CA LYS A 869 -11.797 30.947 21.441 1.00 49.48 C ATOM 563 C LYS A 869 -11.878 29.427 21.400 1.00 45.41 C ATOM 564 O LYS A 869 -11.245 28.785 20.566 1.00 47.52 O ATOM 565 CB LYS A 869 -10.769 31.394 22.475 1.00 50.98 C ATOM 566 H LYS A 869 -13.217 32.099 22.598 1.00 0.00 H ATOM 567 N ASN A 870 -12.663 28.851 22.300 1.00 38.95 N ATOM 568 CA ASN A 870 -12.790 27.407 22.353 1.00 37.11 C ATOM 569 C ASN A 870 -14.137 26.968 22.914 1.00 39.67 C ATOM 570 O ASN A 870 -14.996 27.795 23.223 1.00 37.68 O ATOM 571 CB ASN A 870 -11.652 26.808 23.181 1.00 38.09 C ATOM 572 CG ASN A 870 -11.558 27.415 24.568 1.00 40.14 C ATOM 573 OD1 ASN A 870 -12.561 27.553 25.267 1.00 39.03 O ATOM 574 ND2 ASN A 870 -10.353 27.794 24.967 1.00 40.05 N ATOM 575 HD22 ASN A 870 -9.532 27.658 24.343 1.00 0.00 H ATOM 576 HD21 ASN A 870 -10.228 28.227 25.904 1.00 0.00 H ATOM 577 H ASN A 870 -13.193 29.440 22.974 1.00 0.00 H ATOM 578 N ARG A 871 -14.301 25.656 23.043 1.00 37.33 N ATOM 579 CA ARG A 871 -15.544 25.050 23.501 1.00 35.40 C ATOM 580 C ARG A 871 -15.891 25.439 24.938 1.00 33.14 C ATOM 581 O ARG A 871 -17.051 25.719 25.257 1.00 31.62 O ATOM 582 CB ARG A 871 -15.437 23.529 23.376 1.00 36.99 C ATOM 583 CG ARG A 871 -16.696 22.760 23.701 1.00 35.05 C ATOM 584 CD ARG A 871 -16.598 21.359 23.122 1.00 34.98 C ATOM 585 NE ARG A 871 -16.519 21.389 21.664 1.00 35.58 N ATOM 586 CZ ARG A 871 -16.184 20.348 20.908 1.00 36.30 C ATOM 587 NH1 ARG A 871 -15.883 19.185 21.468 1.00 35.72 N ATOM 588 NH2 ARG A 871 -16.143 20.471 19.588 1.00 39.31 N ATOM 589 HE ARG A 871 -16.740 22.285 21.185 1.00 0.00 H ATOM 590 HH12 ARG A 871 -15.622 18.373 20.873 1.00 0.00 H ATOM 591 HH11 ARG A 871 -15.908 19.084 22.503 1.00 0.00 H ATOM 592 HH22 ARG A 871 -15.881 19.656 18.998 1.00 0.00 H ATOM 593 HH21 ARG A 871 -16.373 21.383 19.143 1.00 0.00 H ATOM 594 H ARG A 871 -13.504 25.032 22.806 1.00 0.00 H ATOM 595 N VAL A 872 -14.881 25.453 25.800 1.00 31.84 N ATOM 596 CA VAL A 872 -15.075 25.758 27.216 1.00 33.44 C ATOM 597 C VAL A 872 -15.565 27.196 27.440 1.00 30.66 C ATOM 598 O VAL A 872 -16.413 27.444 28.304 1.00 29.84 O ATOM 599 CB VAL A 872 -13.766 25.501 28.005 1.00 36.33 C ATOM 600 CG1 VAL A 872 -13.749 26.263 29.314 1.00 39.48 C ATOM 601 CG2 VAL A 872 -13.596 24.009 28.251 1.00 34.23 C ATOM 602 H VAL A 872 -13.923 25.240 25.457 1.00 0.00 H ATOM 603 N GLU A 873 -15.054 28.138 26.652 1.00 32.44 N ATOM 604 CA GLU A 873 -15.475 29.533 26.772 1.00 33.13 C ATOM 605 C GLU A 873 -16.919 29.711 26.318 1.00 32.04 C ATOM 606 O GLU A 873 -17.683 30.457 26.931 1.00 31.56 O ATOM 607 CB GLU A 873 -14.553 30.451 25.964 1.00 35.44 C ATOM 608 CG GLU A 873 -13.129 30.487 26.474 1.00 46.08 C ATOM 609 CD GLU A 873 -13.032 30.998 27.899 1.00 50.57 C ATOM 610 OE1 GLU A 873 -13.743 31.971 28.241 1.00 48.59 O ATOM 611 OE2 GLU A 873 -12.245 30.421 28.678 1.00 53.99 O ATOM 612 H GLU A 873 -14.343 27.878 25.939 1.00 0.00 H ATOM 613 N PHE A 874 -17.277 29.026 25.237 1.00 31.73 N ATOM 614 CA PHE A 874 -18.635 29.056 24.702 1.00 30.70 C ATOM 615 C PHE A 874 -19.620 28.486 25.716 1.00 28.62 C ATOM 616 O PHE A 874 -20.653 29.091 26.008 1.00 27.95 O ATOM 617 CB PHE A 874 -18.691 28.272 23.389 1.00 30.81 C ATOM 618 CG PHE A 874 -20.079 28.004 22.887 1.00 29.53 C ATOM 619 CD1 PHE A 874 -20.913 29.041 22.509 1.00 29.83 C ATOM 620 CD2 PHE A 874 -20.538 26.703 22.770 1.00 28.11 C ATOM 621 CE1 PHE A 874 -22.194 28.782 22.035 1.00 30.17 C ATOM 622 CE2 PHE A 874 -21.817 26.435 22.297 1.00 27.28 C ATOM 623 CZ PHE A 874 -22.644 27.478 21.926 1.00 28.26 C ATOM 624 H PHE A 874 -16.562 28.446 24.753 1.00 0.00 H ATOM 625 N ASP A 875 -19.284 27.322 26.260 1.00 27.68 N ATOM 626 CA ASP A 875 -20.130 26.680 27.265 1.00 25.80 C ATOM 627 C ASP A 875 -20.289 27.549 28.513 1.00 28.10 C ATOM 628 O ASP A 875 -21.346 27.551 29.143 1.00 25.27 O ATOM 629 CB ASP A 875 -19.560 25.315 27.651 1.00 26.40 C ATOM 630 CG ASP A 875 -19.656 24.302 26.525 1.00 27.70 C ATOM 631 OD1 ASP A 875 -20.260 24.612 25.472 1.00 26.35 O ATOM 632 OD2 ASP A 875 -19.144 23.179 26.707 1.00 30.88 O ATOM 633 H ASP A 875 -18.401 26.858 25.965 1.00 0.00 H ATOM 634 N SER A 876 -19.234 28.277 28.867 1.00 27.11 N ATOM 635 CA SER A 876 -19.276 29.172 30.018 1.00 27.39 C ATOM 636 C SER A 876 -20.284 30.292 29.787 1.00 27.35 C ATOM 637 O SER A 876 -21.005 30.692 30.707 1.00 27.10 O ATOM 638 CB SER A 876 -17.889 29.754 30.301 1.00 29.68 C ATOM 639 OG SER A 876 -17.910 30.586 31.449 1.00 29.93 O ATOM 640 HG SER A 876 -18.198 30.056 32.234 1.00 0.00 H ATOM 641 H SER A 876 -18.358 28.207 28.310 1.00 0.00 H ATOM 642 N ALA A 877 -20.344 30.780 28.552 1.00 28.33 N ATOM 643 CA ALA A 877 -21.292 31.821 28.186 1.00 28.54 C ATOM 644 C ALA A 877 -22.715 31.288 28.286 1.00 26.67 C ATOM 645 O ALA A 877 -23.620 31.988 28.737 1.00 26.24 O ATOM 646 CB ALA A 877 -21.013 32.331 26.786 1.00 30.03 C ATOM 647 H ALA A 877 -19.696 30.408 27.828 1.00 0.00 H ATOM 648 N ILE A 878 -22.907 30.039 27.877 1.00 25.63 N ATOM 649 CA ILE A 878 -24.215 29.412 28.018 1.00 23.86 C ATOM 650 C ILE A 878 -24.562 29.290 29.493 1.00 22.75 C ATOM 651 O ILE A 878 -25.658 29.664 29.920 1.00 21.93 O ATOM 652 CB ILE A 878 -24.266 28.018 27.365 1.00 23.02 C ATOM 653 CG1 ILE A 878 -24.112 28.129 25.847 1.00 24.05 C ATOM 654 CG2 ILE A 878 -25.579 27.304 27.734 1.00 21.16 C ATOM 655 CD1 ILE A 878 -23.971 26.785 25.160 1.00 26.61 C ATOM 656 H ILE A 878 -22.120 29.506 27.454 1.00 0.00 H ATOM 657 N ASP A 879 -23.617 28.768 30.267 1.00 22.81 N ATOM 658 CA ASP A 879 -23.850 28.498 31.681 1.00 21.94 C ATOM 659 C ASP A 879 -24.235 29.770 32.444 1.00 23.29 C ATOM 660 O ASP A 879 -25.074 29.728 33.358 1.00 21.56 O ATOM 661 CB ASP A 879 -22.609 27.852 32.297 1.00 22.14 C ATOM 662 CG ASP A 879 -22.893 27.197 33.628 1.00 28.44 C ATOM 663 OD1 ASP A 879 -23.840 26.388 33.710 1.00 25.88 O ATOM 664 OD2 ASP A 879 -22.165 27.494 34.598 1.00 32.28 O ATOM 665 H ASP A 879 -22.688 28.546 29.855 1.00 0.00 H ATOM 666 N LEU A 880 -23.638 30.898 32.059 1.00 23.81 N ATOM 667 CA LEU A 880 -23.949 32.172 32.698 1.00 24.40 C ATOM 668 C LEU A 880 -25.431 32.506 32.528 1.00 24.67 C ATOM 669 O LEU A 880 -26.087 32.976 33.461 1.00 23.02 O ATOM 670 CB LEU A 880 -23.075 33.294 32.126 1.00 26.42 C ATOM 671 CG LEU A 880 -23.131 34.638 32.857 1.00 27.66 C ATOM 672 CD1 LEU A 880 -22.570 34.497 34.267 1.00 29.56 C ATOM 673 CD2 LEU A 880 -22.368 35.704 32.076 1.00 29.52 C ATOM 674 H LEU A 880 -22.939 30.869 31.290 1.00 0.00 H ATOM 675 N VAL A 881 -25.959 32.253 31.336 1.00 23.27 N ATOM 676 CA VAL A 881 -27.363 32.537 31.069 1.00 22.46 C ATOM 677 C VAL A 881 -28.260 31.554 31.827 1.00 20.60 C ATOM 678 O VAL A 881 -29.313 31.940 32.348 1.00 20.41 O ATOM 679 CB VAL A 881 -27.662 32.502 29.557 1.00 22.82 C ATOM 680 CG1 VAL A 881 -29.157 32.706 29.298 1.00 25.20 C ATOM 681 CG2 VAL A 881 -26.850 33.582 28.850 1.00 24.79 C ATOM 682 H VAL A 881 -25.364 31.848 30.585 1.00 0.00 H ATOM 683 N LEU A 882 -27.840 30.294 31.908 1.00 19.86 N ATOM 684 CA LEU A 882 -28.592 29.304 32.674 1.00 18.22 C ATOM 685 C LEU A 882 -28.700 29.722 34.146 1.00 18.11 C ATOM 686 O LEU A 882 -29.750 29.578 34.768 1.00 18.59 O ATOM 687 CB LEU A 882 -27.944 27.924 32.551 1.00 18.12 C ATOM 688 CG LEU A 882 -27.844 27.374 31.130 1.00 18.80 C ATOM 689 CD1 LEU A 882 -27.230 25.991 31.141 1.00 17.53 C ATOM 690 CD2 LEU A 882 -29.219 27.327 30.504 1.00 18.85 C ATOM 691 H LEU A 882 -26.966 30.011 31.420 1.00 0.00 H ATOM 692 N GLU A 883 -27.617 30.261 34.699 1.00 19.09 N ATOM 693 CA GLU A 883 -27.640 30.728 36.083 1.00 19.37 C ATOM 694 C GLU A 883 -28.500 31.972 36.227 1.00 19.85 C ATOM 695 O GLU A 883 -29.210 32.138 37.218 1.00 20.02 O ATOM 696 CB GLU A 883 -26.217 31.006 36.569 1.00 25.09 C ATOM 697 CG GLU A 883 -25.371 29.749 36.703 1.00 33.13 C ATOM 698 CD GLU A 883 -25.887 28.815 37.779 1.00 43.72 C ATOM 699 OE1 GLU A 883 -26.168 29.301 38.900 1.00 46.96 O ATOM 700 OE2 GLU A 883 -26.020 27.601 37.505 1.00 46.69 O ATOM 701 H GLU A 883 -26.745 30.351 34.140 1.00 0.00 H ATOM 702 N GLU A 884 -28.422 32.854 35.238 1.00 21.67 N ATOM 703 CA GLU A 884 -29.232 34.063 35.223 1.00 21.14 C ATOM 704 C GLU A 884 -30.709 33.734 35.376 1.00 22.03 C ATOM 705 O GLU A 884 -31.444 34.432 36.073 1.00 21.96 O ATOM 706 CB GLU A 884 -29.010 34.840 33.928 1.00 23.85 C ATOM 707 CG GLU A 884 -29.911 36.057 33.784 1.00 28.52 C ATOM 708 CD GLU A 884 -29.734 36.770 32.456 1.00 32.31 C ATOM 709 OE1 GLU A 884 -28.907 36.319 31.635 1.00 29.21 O ATOM 710 OE2 GLU A 884 -30.426 37.788 32.236 1.00 35.02 O ATOM 711 H GLU A 884 -27.764 32.676 34.452 1.00 0.00 H ATOM 712 N PHE A 885 -31.132 32.653 34.728 1.00 17.79 N ATOM 713 CA PHE A 885 -32.541 32.279 34.727 1.00 16.17 C ATOM 714 C PHE A 885 -32.857 31.155 35.715 1.00 16.45 C ATOM 715 O PHE A 885 -33.939 30.576 35.658 1.00 17.40 O ATOM 716 CB PHE A 885 -32.978 31.908 33.298 1.00 17.24 C ATOM 717 CG PHE A 885 -33.145 33.107 32.403 1.00 19.19 C ATOM 718 CD1 PHE A 885 -32.055 33.659 31.742 1.00 21.09 C ATOM 719 CD2 PHE A 885 -34.387 33.706 32.252 1.00 23.16 C ATOM 720 CE1 PHE A 885 -32.205 34.776 30.937 1.00 26.64 C ATOM 721 CE2 PHE A 885 -34.541 34.827 31.447 1.00 23.56 C ATOM 722 CZ PHE A 885 -33.450 35.360 30.791 1.00 24.90 C ATOM 723 H PHE A 885 -30.446 32.064 34.213 1.00 0.00 H ATOM 724 N SER A 886 -31.923 30.875 36.627 1.00 16.80 N ATOM 725 CA SER A 886 -32.120 29.862 37.669 1.00 16.39 C ATOM 726 C SER A 886 -32.656 28.550 37.101 1.00 16.39 C ATOM 727 O SER A 886 -33.636 27.981 37.594 1.00 16.53 O ATOM 728 CB SER A 886 -33.067 30.386 38.751 1.00 14.85 C ATOM 729 OG SER A 886 -32.507 31.508 39.410 1.00 19.08 O ATOM 730 HG SER A 886 -33.136 31.829 40.104 1.00 0.00 H ATOM 731 H SER A 886 -31.022 31.394 36.597 1.00 0.00 H ATOM 732 N ILE A 887 -32.010 28.081 36.041 1.00 14.78 N ATOM 733 CA ILE A 887 -32.469 26.903 35.327 1.00 13.52 C ATOM 734 C ILE A 887 -32.181 25.609 36.086 1.00 14.22 C ATOM 735 O ILE A 887 -31.108 25.458 36.685 1.00 16.19 O ATOM 736 CB ILE A 887 -31.819 26.869 33.939 1.00 13.66 C ATOM 737 CG1 ILE A 887 -32.290 28.077 33.118 1.00 14.20 C ATOM 738 CG2 ILE A 887 -32.117 25.551 33.211 1.00 12.89 C ATOM 739 CD1 ILE A 887 -33.809 28.191 32.991 1.00 13.75 C ATOM 740 H ILE A 887 -31.153 28.570 35.713 1.00 0.00 H ATOM 741 N ASP A 888 -33.155 24.696 36.059 1.00 12.07 N ATOM 742 CA ASP A 888 -33.034 23.368 36.662 1.00 13.23 C ATOM 743 C ASP A 888 -32.692 22.273 35.645 1.00 14.76 C ATOM 744 O ASP A 888 -31.966 21.323 35.958 1.00 15.47 O ATOM 745 CB ASP A 888 -34.338 22.975 37.358 1.00 13.52 C ATOM 746 CG ASP A 888 -34.726 23.932 38.452 1.00 12.95 C ATOM 747 OD1 ASP A 888 -33.898 24.156 39.367 1.00 16.01 O ATOM 748 OD2 ASP A 888 -35.861 24.460 38.412 1.00 14.24 O ATOM 749 H ASP A 888 -34.047 24.942 35.584 1.00 0.00 H ATOM 750 N ILE A 889 -33.262 22.393 34.450 1.00 11.88 N ATOM 751 CA ILE A 889 -33.164 21.353 33.433 1.00 11.69 C ATOM 752 C ILE A 889 -32.862 21.993 32.085 1.00 13.11 C ATOM 753 O ILE A 889 -33.450 23.017 31.738 1.00 12.89 O ATOM 754 CB ILE A 889 -34.469 20.523 33.330 1.00 11.46 C ATOM 755 CG1 ILE A 889 -34.703 19.745 34.627 1.00 11.84 C ATOM 756 CG2 ILE A 889 -34.428 19.568 32.131 1.00 13.10 C ATOM 757 CD1 ILE A 889 -36.115 19.156 34.727 1.00 13.50 C ATOM 758 H ILE A 889 -33.796 23.259 34.233 1.00 0.00 H ATOM 759 N VAL A 890 -31.940 21.392 31.340 1.00 11.51 N ATOM 760 CA VAL A 890 -31.598 21.848 30.000 1.00 12.41 C ATOM 761 C VAL A 890 -32.062 20.836 28.968 1.00 11.84 C ATOM 762 O VAL A 890 -31.782 19.652 29.122 1.00 12.20 O ATOM 763 CB VAL A 890 -30.083 22.044 29.854 1.00 13.02 C ATOM 764 CG1 VAL A 890 -29.733 22.500 28.427 1.00 15.74 C ATOM 765 CG2 VAL A 890 -29.591 23.038 30.891 1.00 13.73 C ATOM 766 H VAL A 890 -31.444 20.565 31.729 1.00 0.00 H ATOM 767 N CYS A 891 -32.759 21.297 27.923 1.00 11.25 N ATOM 768 CA CYS A 891 -33.141 20.441 26.793 1.00 10.89 C ATOM 769 C CYS A 891 -32.387 20.861 25.544 1.00 12.50 C ATOM 770 O CYS A 891 -32.455 22.023 25.153 1.00 14.18 O ATOM 771 CB CYS A 891 -34.644 20.522 26.522 1.00 11.94 C ATOM 772 SG CYS A 891 -35.648 19.749 27.788 1.00 11.91 S ATOM 773 H CYS A 891 -33.040 22.298 27.911 1.00 0.00 H ATOM 774 N LEU A 892 -31.667 19.921 24.934 1.00 11.96 N ATOM 775 CA LEU A 892 -31.012 20.163 23.650 1.00 12.72 C ATOM 776 C LEU A 892 -31.978 19.717 22.551 1.00 12.20 C ATOM 777 O LEU A 892 -32.290 18.532 22.427 1.00 12.73 O ATOM 778 CB LEU A 892 -29.684 19.406 23.548 1.00 13.40 C ATOM 779 CG LEU A 892 -28.722 19.579 24.725 1.00 13.94 C ATOM 780 CD1 LEU A 892 -27.414 18.855 24.423 1.00 14.97 C ATOM 781 CD2 LEU A 892 -28.483 21.055 25.028 1.00 16.23 C ATOM 782 H LEU A 892 -31.568 18.989 25.384 1.00 0.00 H ATOM 783 N ALA A 893 -32.494 20.682 21.800 1.00 13.00 N ATOM 784 CA ALA A 893 -33.551 20.414 20.831 1.00 14.46 C ATOM 785 C ALA A 893 -33.102 20.897 19.456 1.00 15.45 C ATOM 786 O ALA A 893 -33.400 22.014 19.039 1.00 16.75 O ATOM 787 CB ALA A 893 -34.846 21.093 21.264 1.00 11.46 C ATOM 788 H ALA A 893 -32.136 21.653 21.905 1.00 0.00 H ATOM 789 N GLY A 894 -32.359 20.050 18.757 1.00 15.47 N ATOM 790 CA GLY A 894 -31.750 20.448 17.502 1.00 15.70 C ATOM 791 C GLY A 894 -30.515 21.314 17.691 1.00 16.83 C ATOM 792 O GLY A 894 -30.051 21.949 16.752 1.00 19.38 O ATOM 793 H GLY A 894 -32.210 19.085 19.114 1.00 0.00 H ATOM 794 N PHE A 895 -29.986 21.339 18.915 1.00 17.20 N ATOM 795 CA PHE A 895 -28.738 22.033 19.224 1.00 16.21 C ATOM 796 C PHE A 895 -27.575 21.193 18.723 1.00 19.86 C ATOM 797 O PHE A 895 -27.452 20.032 19.100 1.00 22.18 O ATOM 798 CB PHE A 895 -28.641 22.270 20.740 1.00 17.23 C ATOM 799 CG PHE A 895 -27.422 23.034 21.169 1.00 18.46 C ATOM 800 CD1 PHE A 895 -27.348 24.410 20.995 1.00 18.97 C ATOM 801 CD2 PHE A 895 -26.358 22.378 21.773 1.00 20.15 C ATOM 802 CE1 PHE A 895 -26.233 25.120 21.412 1.00 20.72 C ATOM 803 CE2 PHE A 895 -25.239 23.078 22.195 1.00 23.04 C ATOM 804 CZ PHE A 895 -25.172 24.451 22.011 1.00 25.32 C ATOM 805 H PHE A 895 -30.483 20.843 19.682 1.00 0.00 H ATOM 806 N MET A 896 -26.732 21.747 17.859 1.00 19.28 N ATOM 807 CA MET A 896 -25.780 20.898 17.154 1.00 22.08 C ATOM 808 C MET A 896 -24.331 21.141 17.555 1.00 19.90 C ATOM 809 O MET A 896 -23.438 21.025 16.723 1.00 26.53 O ATOM 810 CB MET A 896 -25.928 21.076 15.633 1.00 25.17 C ATOM 811 CG MET A 896 -27.307 20.722 15.066 1.00 25.88 C ATOM 812 SD MET A 896 -27.902 19.060 15.478 1.00 31.21 S ATOM 813 CE MET A 896 -26.768 18.052 14.528 1.00 40.70 C ATOM 814 H MET A 896 -26.751 22.773 17.688 1.00 0.00 H ATOM 815 N ARG A 897 -24.095 21.448 18.826 1.00 21.54 N ATOM 816 CA ARG A 897 -22.729 21.575 19.328 1.00 22.91 C ATOM 817 C ARG A 897 -22.443 20.514 20.381 1.00 23.81 C ATOM 818 O ARG A 897 -23.294 20.218 21.221 1.00 21.37 O ATOM 819 CB ARG A 897 -22.481 22.963 19.927 1.00 26.83 C ATOM 820 CG ARG A 897 -22.752 24.116 18.989 1.00 26.96 C ATOM 821 CD ARG A 897 -21.851 24.063 17.774 1.00 27.94 C ATOM 822 NE ARG A 897 -20.446 24.258 18.123 1.00 28.98 N ATOM 823 CZ ARG A 897 -19.465 24.315 17.227 1.00 37.15 C ATOM 824 NH1 ARG A 897 -19.745 24.191 15.938 1.00 39.44 N ATOM 825 NH2 ARG A 897 -18.210 24.497 17.617 1.00 37.77 N ATOM 826 HE ARG A 897 -20.199 24.358 19.128 1.00 0.00 H ATOM 827 HH12 ARG A 897 -18.981 24.235 15.233 1.00 0.00 H ATOM 828 HH11 ARG A 897 -20.728 24.050 15.631 1.00 0.00 H ATOM 829 HH22 ARG A 897 -17.447 24.541 16.911 1.00 0.00 H ATOM 830 HH21 ARG A 897 -17.989 24.596 18.628 1.00 0.00 H ATOM 831 H ARG A 897 -24.895 21.600 19.473 1.00 0.00 H ATOM 832 N ILE A 898 -21.246 19.941 20.312 1.00 23.79 N ATOM 833 CA ILE A 898 -20.740 19.066 21.359 1.00 22.86 C ATOM 834 C ILE A 898 -20.375 19.904 22.574 1.00 23.08 C ATOM 835 O ILE A 898 -19.690 20.911 22.448 1.00 24.24 O ATOM 836 CB ILE A 898 -19.513 18.268 20.877 1.00 24.04 C ATOM 837 CG1 ILE A 898 -19.912 17.347 19.723 1.00 24.87 C ATOM 838 CG2 ILE A 898 -18.891 17.482 22.027 1.00 25.89 C ATOM 839 CD1 ILE A 898 -18.758 16.574 19.121 1.00 28.93 C ATOM 840 H ILE A 898 -20.649 20.124 19.480 1.00 0.00 H ATOM 841 N LEU A 899 -20.848 19.494 23.746 1.00 21.18 N ATOM 842 CA LEU A 899 -20.599 20.227 24.981 1.00 23.30 C ATOM 843 C LEU A 899 -19.360 19.697 25.689 1.00 23.04 C ATOM 844 O LEU A 899 -19.041 18.509 25.596 1.00 23.43 O ATOM 845 CB LEU A 899 -21.811 20.135 25.902 1.00 19.33 C ATOM 846 CG LEU A 899 -23.071 20.775 25.330 1.00 23.00 C ATOM 847 CD1 LEU A 899 -24.289 20.264 26.056 1.00 22.83 C ATOM 848 CD2 LEU A 899 -22.978 22.285 25.441 1.00 22.48 C ATOM 849 H LEU A 899 -21.414 18.622 23.783 1.00 0.00 H ATOM 850 N SER A 900 -18.665 20.586 26.393 1.00 23.77 N ATOM 851 CA SER A 900 -17.435 20.236 27.091 1.00 23.21 C ATOM 852 C SER A 900 -17.690 19.360 28.307 1.00 26.15 C ATOM 853 O SER A 900 -18.779 19.380 28.880 1.00 22.09 O ATOM 854 CB SER A 900 -16.698 21.498 27.537 1.00 28.23 C ATOM 855 OG SER A 900 -17.395 22.126 28.599 1.00 27.85 O ATOM 856 HG SER A 900 -16.906 22.941 28.877 1.00 0.00 H ATOM 857 H SER A 900 -19.012 21.565 26.447 1.00 0.00 H ATOM 858 N GLY A 901 -16.666 18.611 28.706 1.00 26.54 N ATOM 859 CA GLY A 901 -16.759 17.728 29.856 1.00 26.25 C ATOM 860 C GLY A 901 -17.246 18.381 31.138 1.00 23.94 C ATOM 861 O GLY A 901 -18.162 17.874 31.783 1.00 23.23 O ATOM 862 H GLY A 901 -15.771 18.659 28.178 1.00 0.00 H ATOM 863 N PRO A 902 -16.623 19.499 31.537 1.00 26.91 N ATOM 864 CA PRO A 902 -17.055 20.124 32.791 1.00 25.27 C ATOM 865 C PRO A 902 -18.508 20.619 32.757 1.00 24.05 C ATOM 866 O PRO A 902 -19.199 20.540 33.775 1.00 23.43 O ATOM 867 CB PRO A 902 -16.074 21.293 32.952 1.00 26.10 C ATOM 868 CG PRO A 902 -14.850 20.839 32.230 1.00 28.02 C ATOM 869 CD PRO A 902 -15.353 20.069 31.048 1.00 26.47 C ATOM 870 N PHE A 903 -18.955 21.125 31.612 1.00 24.14 N ATOM 871 CA PHE A 903 -20.325 21.607 31.492 1.00 21.54 C ATOM 872 C PHE A 903 -21.284 20.426 31.635 1.00 20.75 C ATOM 873 O PHE A 903 -22.285 20.497 32.356 1.00 20.24 O ATOM 874 CB PHE A 903 -20.524 22.338 30.155 1.00 21.26 C ATOM 875 CG PHE A 903 -21.906 22.902 29.964 1.00 21.25 C ATOM 876 CD1 PHE A 903 -22.908 22.141 29.371 1.00 19.77 C ATOM 877 CD2 PHE A 903 -22.210 24.183 30.389 1.00 22.28 C ATOM 878 CE1 PHE A 903 -24.184 22.659 29.195 1.00 20.13 C ATOM 879 CE2 PHE A 903 -23.479 24.709 30.212 1.00 20.06 C ATOM 880 CZ PHE A 903 -24.468 23.949 29.620 1.00 20.79 C ATOM 881 H PHE A 903 -18.319 21.178 30.791 1.00 0.00 H ATOM 882 N VAL A 904 -20.961 19.331 30.957 1.00 19.21 N ATOM 883 CA VAL A 904 -21.762 18.118 31.048 1.00 18.20 C ATOM 884 C VAL A 904 -21.803 17.577 32.480 1.00 18.00 C ATOM 885 O VAL A 904 -22.865 17.188 32.973 1.00 18.46 O ATOM 886 CB VAL A 904 -21.228 17.040 30.081 1.00 18.50 C ATOM 887 CG1 VAL A 904 -21.906 15.694 30.321 1.00 21.62 C ATOM 888 CG2 VAL A 904 -21.423 17.497 28.637 1.00 20.93 C ATOM 889 H VAL A 904 -20.118 19.340 30.348 1.00 0.00 H ATOM 890 N GLN A 905 -20.661 17.570 33.163 1.00 19.85 N ATOM 891 CA GLN A 905 -20.648 17.066 34.530 1.00 21.95 C ATOM 892 C GLN A 905 -21.485 17.954 35.447 1.00 19.23 C ATOM 893 O GLN A 905 -22.222 17.453 36.308 1.00 18.45 O ATOM 894 CB GLN A 905 -19.219 16.946 35.063 1.00 26.73 C ATOM 895 CG GLN A 905 -19.104 15.912 36.173 1.00 34.73 C ATOM 896 CD GLN A 905 -19.617 14.541 35.745 1.00 39.65 C ATOM 897 OE1 GLN A 905 -19.393 14.104 34.615 1.00 43.70 O ATOM 898 NE2 GLN A 905 -20.320 13.865 36.647 1.00 41.80 N ATOM 899 HE22 GLN A 905 -20.485 14.272 37.590 1.00 0.00 H ATOM 900 HE21 GLN A 905 -20.705 12.928 36.411 1.00 0.00 H ATOM 901 H GLN A 905 -19.786 17.921 32.725 1.00 0.00 H ATOM 902 N LYS A 906 -21.398 19.269 35.254 1.00 19.04 N ATOM 903 CA LYS A 906 -22.162 20.194 36.089 1.00 20.17 C ATOM 904 C LYS A 906 -23.659 19.929 35.955 1.00 20.02 C ATOM 905 O LYS A 906 -24.400 19.966 36.943 1.00 20.29 O ATOM 906 CB LYS A 906 -21.860 21.650 35.728 1.00 22.26 C ATOM 907 CG LYS A 906 -22.763 22.640 36.461 1.00 23.37 C ATOM 908 CD LYS A 906 -22.368 24.090 36.227 1.00 25.02 C ATOM 909 CE LYS A 906 -23.371 25.033 36.884 1.00 26.46 C ATOM 910 NZ LYS A 906 -22.853 26.431 36.936 1.00 28.42 N ATOM 911 HZ1 LYS A 906 -21.971 26.452 37.486 1.00 0.00 H ATOM 912 HZ2 LYS A 906 -22.668 26.767 35.969 1.00 0.00 H ATOM 913 HZ3 LYS A 906 -23.560 27.045 37.389 1.00 0.00 H ATOM 914 H LYS A 906 -20.782 19.641 34.503 1.00 0.00 H ATOM 915 N TRP A 907 -24.095 19.640 34.734 1.00 18.88 N ATOM 916 CA TRP A 907 -25.515 19.464 34.468 1.00 16.88 C ATOM 917 C TRP A 907 -25.918 17.999 34.425 1.00 17.84 C ATOM 918 O TRP A 907 -27.004 17.659 33.952 1.00 16.43 O ATOM 919 CB TRP A 907 -25.892 20.174 33.163 1.00 15.89 C ATOM 920 CG TRP A 907 -25.831 21.660 33.359 1.00 17.23 C ATOM 921 CD1 TRP A 907 -24.773 22.484 33.095 1.00 19.97 C ATOM 922 CD2 TRP A 907 -26.854 22.493 33.930 1.00 18.08 C ATOM 923 NE1 TRP A 907 -25.081 23.780 33.448 1.00 19.73 N ATOM 924 CE2 TRP A 907 -26.356 23.810 33.955 1.00 19.70 C ATOM 925 CE3 TRP A 907 -28.153 22.251 34.405 1.00 17.98 C ATOM 926 CZ2 TRP A 907 -27.104 24.881 34.442 1.00 21.74 C ATOM 927 CZ3 TRP A 907 -28.892 23.314 34.877 1.00 18.75 C ATOM 928 CH2 TRP A 907 -28.366 24.612 34.900 1.00 22.52 C ATOM 929 HE1 TRP A 907 -24.451 24.601 33.347 1.00 0.00 H ATOM 930 H TRP A 907 -23.412 19.538 33.957 1.00 0.00 H ATOM 931 N ASN A 908 -25.059 17.137 34.962 1.00 17.85 N ATOM 932 CA ASN A 908 -25.323 15.704 34.952 1.00 17.61 C ATOM 933 C ASN A 908 -26.655 15.370 35.639 1.00 16.87 C ATOM 934 O ASN A 908 -26.902 15.779 36.781 1.00 17.92 O ATOM 935 CB ASN A 908 -24.161 14.948 35.621 1.00 19.36 C ATOM 936 CG ASN A 908 -24.282 13.438 35.473 1.00 19.81 C ATOM 937 OD1 ASN A 908 -24.433 12.913 34.370 1.00 23.28 O ATOM 938 ND2 ASN A 908 -24.236 12.736 36.596 1.00 27.85 N ATOM 939 HD22 ASN A 908 -24.107 13.220 37.507 1.00 0.00 H ATOM 940 HD21 ASN A 908 -24.329 11.701 36.566 1.00 0.00 H ATOM 941 H ASN A 908 -24.183 17.492 35.397 1.00 0.00 H ATOM 942 N GLY A 909 -27.502 14.641 34.918 1.00 16.79 N ATOM 943 CA GLY A 909 -28.811 14.244 35.404 1.00 19.18 C ATOM 944 C GLY A 909 -29.852 15.330 35.216 1.00 15.07 C ATOM 945 O GLY A 909 -31.002 15.168 35.626 1.00 16.88 O ATOM 946 H GLY A 909 -27.214 14.342 33.964 1.00 0.00 H ATOM 947 N LYS A 910 -29.465 16.435 34.584 1.00 14.34 N ATOM 948 CA LYS A 910 -30.390 17.549 34.387 1.00 14.38 C ATOM 949 C LYS A 910 -30.440 18.029 32.940 1.00 13.98 C ATOM 950 O LYS A 910 -31.114 19.007 32.627 1.00 12.69 O ATOM 951 CB LYS A 910 -30.008 18.718 35.300 1.00 15.32 C ATOM 952 CG LYS A 910 -29.991 18.368 36.777 1.00 17.38 C ATOM 953 CD LYS A 910 -31.358 17.914 37.268 1.00 18.28 C ATOM 954 CE LYS A 910 -31.305 17.574 38.754 1.00 21.92 C ATOM 955 NZ LYS A 910 -32.634 17.193 39.305 1.00 21.93 N ATOM 956 HZ1 LYS A 910 -33.298 17.984 39.182 1.00 0.00 H ATOM 957 HZ2 LYS A 910 -32.991 16.357 38.799 1.00 0.00 H ATOM 958 HZ3 LYS A 910 -32.538 16.973 40.317 1.00 0.00 H ATOM 959 H LYS A 910 -28.491 16.507 34.225 1.00 0.00 H ATOM 960 N MET A 911 -29.736 17.336 32.054 1.00 12.30 N ATOM 961 CA MET A 911 -29.672 17.771 30.669 1.00 12.08 C ATOM 962 C MET A 911 -30.072 16.639 29.734 1.00 13.86 C ATOM 963 O MET A 911 -29.514 15.545 29.819 1.00 12.93 O ATOM 964 CB MET A 911 -28.267 18.299 30.339 1.00 12.92 C ATOM 965 CG MET A 911 -28.160 18.773 28.899 1.00 12.90 C ATOM 966 SD MET A 911 -26.794 19.925 28.670 1.00 19.30 S ATOM 967 CE MET A 911 -25.418 19.018 29.390 1.00 16.93 C ATOM 968 H MET A 911 -29.228 16.479 32.352 1.00 0.00 H ATOM 969 N LEU A 912 -31.061 16.923 28.879 1.00 11.96 N ATOM 970 CA LEU A 912 -31.677 15.948 27.978 1.00 11.11 C ATOM 971 C LEU A 912 -31.378 16.308 26.528 1.00 12.81 C ATOM 972 O LEU A 912 -31.313 17.487 26.188 1.00 12.02 O ATOM 973 CB LEU A 912 -33.196 15.901 28.158 1.00 11.04 C ATOM 974 CG LEU A 912 -33.805 15.315 29.430 1.00 14.69 C ATOM 975 CD1 LEU A 912 -33.446 16.141 30.637 1.00 19.37 C ATOM 976 CD2 LEU A 912 -35.317 15.237 29.265 1.00 15.54 C ATOM 977 H LEU A 912 -31.415 17.900 28.853 1.00 0.00 H ATOM 978 N ASN A 913 -31.223 15.293 25.681 1.00 10.79 N ATOM 979 CA ASN A 913 -31.038 15.497 24.240 1.00 10.06 C ATOM 980 C ASN A 913 -31.977 14.608 23.446 1.00 10.95 C ATOM 981 O ASN A 913 -32.288 13.505 23.883 1.00 10.65 O ATOM 982 CB ASN A 913 -29.581 15.200 23.843 1.00 11.27 C ATOM 983 CG ASN A 913 -29.323 15.393 22.359 1.00 12.93 C ATOM 984 OD1 ASN A 913 -29.520 16.482 21.818 1.00 12.56 O ATOM 985 ND2 ASN A 913 -28.863 14.333 21.693 1.00 13.01 N ATOM 986 HD22 ASN A 913 -28.711 13.432 22.190 1.00 0.00 H ATOM 987 HD21 ASN A 913 -28.656 14.407 20.676 1.00 0.00 H ATOM 988 H ASN A 913 -31.233 14.322 26.053 1.00 0.00 H ATOM 989 N ILE A 914 -32.412 15.082 22.278 1.00 9.98 N ATOM 990 CA ILE A 914 -33.178 14.242 21.354 1.00 10.19 C ATOM 991 C ILE A 914 -32.268 13.886 20.178 1.00 11.87 C ATOM 992 O ILE A 914 -31.548 14.732 19.648 1.00 12.51 O ATOM 993 CB ILE A 914 -34.479 14.930 20.858 1.00 10.88 C ATOM 994 CG1 ILE A 914 -35.272 14.009 19.920 1.00 16.36 C ATOM 995 CG2 ILE A 914 -34.207 16.246 20.161 1.00 13.27 C ATOM 996 CD1 ILE A 914 -36.352 13.263 20.591 1.00 18.12 C ATOM 997 H ILE A 914 -32.203 16.067 22.018 1.00 0.00 H ATOM 998 N HIS A 915 -32.295 12.617 19.793 1.00 10.05 N ATOM 999 CA HIS A 915 -31.465 12.135 18.703 1.00 11.36 C ATOM 1000 C HIS A 915 -32.317 11.283 17.773 1.00 10.40 C ATOM 1001 O HIS A 915 -33.044 10.415 18.238 1.00 9.13 O ATOM 1002 CB HIS A 915 -30.297 11.325 19.253 1.00 11.80 C ATOM 1003 CG HIS A 915 -29.397 10.782 18.195 1.00 11.57 C ATOM 1004 ND1 HIS A 915 -28.384 11.524 17.630 1.00 14.49 N ATOM 1005 CD2 HIS A 915 -29.356 9.567 17.600 1.00 14.00 C ATOM 1006 CE1 HIS A 915 -27.764 10.794 16.719 1.00 16.19 C ATOM 1007 NE2 HIS A 915 -28.330 9.600 16.690 1.00 13.82 N ATOM 1008 H HIS A 915 -32.926 11.951 20.283 1.00 0.00 H ATOM 1009 N PRO A 916 -32.222 11.518 16.451 1.00 10.43 N ATOM 1010 CA PRO A 916 -33.142 10.864 15.510 1.00 10.77 C ATOM 1011 C PRO A 916 -32.687 9.478 15.033 1.00 10.03 C ATOM 1012 O PRO A 916 -32.686 9.192 13.832 1.00 10.74 O ATOM 1013 CB PRO A 916 -33.186 11.849 14.341 1.00 10.55 C ATOM 1014 CG PRO A 916 -31.797 12.415 14.328 1.00 10.37 C ATOM 1015 CD PRO A 916 -31.395 12.541 15.790 1.00 10.51 C ATOM 1016 N SER A 917 -32.321 8.624 15.983 1.00 9.56 N ATOM 1017 CA SER A 917 -32.164 7.195 15.725 1.00 8.05 C ATOM 1018 C SER A 917 -32.560 6.445 16.988 1.00 9.35 C ATOM 1019 O SER A 917 -32.751 7.044 18.054 1.00 9.98 O ATOM 1020 CB SER A 917 -30.724 6.843 15.330 1.00 9.14 C ATOM 1021 OG SER A 917 -29.876 6.896 16.467 1.00 10.71 O ATOM 1022 HG SER A 917 -28.951 6.667 16.198 1.00 0.00 H ATOM 1023 H SER A 917 -32.140 8.985 16.942 1.00 0.00 H ATOM 1024 N LEU A 918 -32.667 5.131 16.864 1.00 8.04 N ATOM 1025 CA LEU A 918 -32.746 4.276 18.040 1.00 7.74 C ATOM 1026 C LEU A 918 -31.325 3.975 18.518 1.00 8.58 C ATOM 1027 O LEU A 918 -30.672 3.027 18.048 1.00 9.53 O ATOM 1028 CB LEU A 918 -33.496 2.984 17.719 1.00 9.40 C ATOM 1029 CG LEU A 918 -34.973 3.135 17.360 1.00 7.89 C ATOM 1030 CD1 LEU A 918 -35.520 1.764 16.965 1.00 9.13 C ATOM 1031 CD2 LEU A 918 -35.765 3.672 18.547 1.00 8.93 C ATOM 1032 H LEU A 918 -32.695 4.705 15.916 1.00 0.00 H ATOM 1033 N LEU A 919 -30.821 4.811 19.426 1.00 8.44 N ATOM 1034 CA LEU A 919 -29.502 4.570 19.993 1.00 9.35 C ATOM 1035 C LEU A 919 -29.513 3.183 20.625 1.00 10.34 C ATOM 1036 O LEU A 919 -30.527 2.752 21.179 1.00 10.68 O ATOM 1037 CB LEU A 919 -29.146 5.655 21.011 1.00 9.98 C ATOM 1038 CG LEU A 919 -28.928 7.027 20.374 1.00 11.15 C ATOM 1039 CD1 LEU A 919 -28.808 8.091 21.467 1.00 12.26 C ATOM 1040 CD2 LEU A 919 -27.704 7.027 19.483 1.00 11.12 C ATOM 1041 H LEU A 919 -31.372 5.639 19.730 1.00 0.00 H ATOM 1042 N PRO A 920 -28.391 2.471 20.556 1.00 9.49 N ATOM 1043 CA PRO A 920 -27.055 2.936 20.147 1.00 10.19 C ATOM 1044 C PRO A 920 -26.735 2.903 18.641 1.00 12.10 C ATOM 1045 O PRO A 920 -25.582 3.161 18.274 1.00 14.10 O ATOM 1046 CB PRO A 920 -26.130 1.972 20.900 1.00 12.53 C ATOM 1047 CG PRO A 920 -26.925 0.688 20.945 1.00 11.70 C ATOM 1048 CD PRO A 920 -28.351 1.120 21.149 1.00 10.86 C ATOM 1049 N SER A 921 -27.706 2.607 17.781 1.00 9.83 N ATOM 1050 CA SER A 921 -27.450 2.694 16.340 1.00 10.23 C ATOM 1051 C SER A 921 -27.345 4.146 15.895 1.00 9.05 C ATOM 1052 O SER A 921 -28.041 5.027 16.424 1.00 10.63 O ATOM 1053 CB SER A 921 -28.558 2.024 15.515 1.00 9.95 C ATOM 1054 OG SER A 921 -28.543 0.611 15.657 1.00 12.90 O ATOM 1055 HG SER A 921 -29.270 0.218 15.112 1.00 0.00 H ATOM 1056 H SER A 921 -28.642 2.315 18.129 1.00 0.00 H ATOM 1057 N PHE A 922 -26.475 4.363 14.909 1.00 11.51 N ATOM 1058 CA PHE A 922 -26.406 5.621 14.154 1.00 10.00 C ATOM 1059 C PHE A 922 -26.186 6.842 15.048 1.00 12.21 C ATOM 1060 O PHE A 922 -26.922 7.829 14.983 1.00 12.61 O ATOM 1061 CB PHE A 922 -27.666 5.787 13.293 1.00 9.49 C ATOM 1062 CG PHE A 922 -28.025 4.548 12.514 1.00 9.70 C ATOM 1063 CD1 PHE A 922 -27.067 3.886 11.775 1.00 10.42 C ATOM 1064 CD2 PHE A 922 -29.316 4.038 12.545 1.00 9.83 C ATOM 1065 CE1 PHE A 922 -27.384 2.732 11.069 1.00 11.57 C ATOM 1066 CE2 PHE A 922 -29.642 2.885 11.842 1.00 11.25 C ATOM 1067 CZ PHE A 922 -28.668 2.232 11.104 1.00 10.78 C ATOM 1068 H PHE A 922 -25.811 3.602 14.661 1.00 0.00 H ATOM 1069 N LYS A 923 -25.145 6.764 15.869 1.00 13.18 N ATOM 1070 CA LYS A 923 -24.700 7.925 16.644 1.00 13.91 C ATOM 1071 C LYS A 923 -24.151 8.978 15.693 1.00 17.20 C ATOM 1072 O LYS A 923 -23.708 8.647 14.604 1.00 17.38 O ATOM 1073 CB LYS A 923 -23.631 7.526 17.661 1.00 15.97 C ATOM 1074 CG LYS A 923 -24.070 6.442 18.631 1.00 17.38 C ATOM 1075 CD LYS A 923 -22.947 6.035 19.577 1.00 23.58 C ATOM 1076 CE LYS A 923 -23.480 5.119 20.672 1.00 27.12 C ATOM 1077 NZ LYS A 923 -22.453 4.812 21.711 1.00 32.04 N ATOM 1078 HZ1 LYS A 923 -21.641 4.340 21.265 1.00 0.00 H ATOM 1079 HZ2 LYS A 923 -22.139 5.697 22.158 1.00 0.00 H ATOM 1080 HZ3 LYS A 923 -22.867 4.186 22.431 1.00 0.00 H ATOM 1081 H LYS A 923 -24.636 5.862 15.964 1.00 0.00 H ATOM 1082 N GLY A 924 -24.167 10.242 16.101 1.00 18.58 N ATOM 1083 CA GLY A 924 -23.563 11.280 15.277 1.00 21.33 C ATOM 1084 C GLY A 924 -24.548 12.148 14.518 1.00 25.37 C ATOM 1085 O GLY A 924 -25.754 12.053 14.720 1.00 24.77 O ATOM 1086 H GLY A 924 -24.611 10.490 17.008 1.00 0.00 H ATOM 1087 N SER A 925 -24.033 12.973 13.603 1.00 23.52 N ATOM 1088 CA SER A 925 -24.787 14.122 13.094 1.00 26.25 C ATOM 1089 C SER A 925 -25.732 13.879 11.912 1.00 30.91 C ATOM 1090 O SER A 925 -26.616 14.705 11.638 1.00 38.16 O ATOM 1091 CB SER A 925 -23.801 15.212 12.690 1.00 34.71 C ATOM 1092 OG SER A 925 -23.029 14.743 11.607 1.00 35.98 O ATOM 1093 HG SER A 925 -22.384 15.443 11.335 1.00 0.00 H ATOM 1094 H SER A 925 -23.074 12.796 13.243 1.00 0.00 H ATOM 1095 N ASN A 926 -25.550 12.747 11.242 1.00 18.63 N ATOM 1096 CA ASN A 926 -26.299 12.406 10.034 1.00 16.57 C ATOM 1097 C ASN A 926 -27.035 11.079 10.173 1.00 14.12 C ATOM 1098 O ASN A 926 -26.912 10.196 9.319 1.00 13.29 O ATOM 1099 CB ASN A 926 -25.353 12.328 8.848 1.00 18.72 C ATOM 1100 CG ASN A 926 -24.270 11.295 9.055 1.00 20.28 C ATOM 1101 OD1 ASN A 926 -23.975 10.913 10.194 1.00 21.88 O ATOM 1102 ND2 ASN A 926 -23.694 10.808 7.962 1.00 22.41 N ATOM 1103 HD22 ASN A 926 -23.975 11.161 7.025 1.00 0.00 H ATOM 1104 HD21 ASN A 926 -22.962 10.074 8.043 1.00 0.00 H ATOM 1105 H ASN A 926 -24.841 12.072 11.593 1.00 0.00 H ATOM 1106 N ALA A 927 -27.796 10.936 11.250 1.00 12.86 N ATOM 1107 CA ALA A 927 -28.377 9.645 11.577 1.00 11.54 C ATOM 1108 C ALA A 927 -29.260 9.094 10.461 1.00 11.58 C ATOM 1109 O ALA A 927 -29.205 7.905 10.182 1.00 10.90 O ATOM 1110 CB ALA A 927 -29.162 9.738 12.881 1.00 12.58 C ATOM 1111 H ALA A 927 -27.978 11.754 11.865 1.00 0.00 H ATOM 1112 N HIS A 928 -30.059 9.937 9.813 1.00 9.86 N ATOM 1113 CA HIS A 928 -30.947 9.428 8.762 1.00 10.08 C ATOM 1114 C HIS A 928 -30.149 8.927 7.571 1.00 10.04 C ATOM 1115 O HIS A 928 -30.491 7.905 6.984 1.00 10.16 O ATOM 1116 CB HIS A 928 -31.939 10.493 8.304 1.00 10.96 C ATOM 1117 CG HIS A 928 -32.849 10.965 9.389 1.00 9.53 C ATOM 1118 ND1 HIS A 928 -33.647 10.105 10.108 1.00 10.54 N ATOM 1119 CD2 HIS A 928 -33.085 12.205 9.877 1.00 12.90 C ATOM 1120 CE1 HIS A 928 -34.337 10.797 11.000 1.00 11.33 C ATOM 1121 NE2 HIS A 928 -34.017 12.072 10.878 1.00 13.01 N ATOM 1122 H HIS A 928 -30.054 10.950 10.050 1.00 0.00 H ATOM 1123 N GLU A 929 -29.095 9.656 7.207 1.00 11.71 N ATOM 1124 CA GLU A 929 -28.236 9.198 6.116 1.00 11.28 C ATOM 1125 C GLU A 929 -27.685 7.817 6.433 1.00 11.80 C ATOM 1126 O GLU A 929 -27.627 6.943 5.567 1.00 12.46 O ATOM 1127 CB GLU A 929 -27.090 10.181 5.872 1.00 13.10 C ATOM 1128 CG GLU A 929 -27.511 11.495 5.256 1.00 13.75 C ATOM 1129 CD GLU A 929 -26.319 12.336 4.837 1.00 15.92 C ATOM 1130 OE1 GLU A 929 -25.183 11.991 5.236 1.00 19.28 O ATOM 1131 OE2 GLU A 929 -26.507 13.340 4.107 1.00 18.10 O ATOM 1132 H GLU A 929 -28.884 10.548 7.698 1.00 0.00 H ATOM 1133 N GLN A 930 -27.274 7.629 7.683 1.00 11.42 N ATOM 1134 CA GLN A 930 -26.721 6.349 8.105 1.00 11.29 C ATOM 1135 C GLN A 930 -27.761 5.243 8.050 1.00 13.05 C ATOM 1136 O GLN A 930 -27.487 4.134 7.576 1.00 12.18 O ATOM 1137 CB GLN A 930 -26.173 6.442 9.522 1.00 10.87 C ATOM 1138 CG GLN A 930 -24.956 7.330 9.703 1.00 12.00 C ATOM 1139 CD GLN A 930 -24.497 7.297 11.145 1.00 11.79 C ATOM 1140 OE1 GLN A 930 -24.162 6.224 11.677 1.00 14.81 O ATOM 1141 NE2 GLN A 930 -24.498 8.453 11.798 1.00 14.74 N ATOM 1142 HE22 GLN A 930 -24.786 9.325 11.311 1.00 0.00 H ATOM 1143 HE21 GLN A 930 -24.210 8.486 12.797 1.00 0.00 H ATOM 1144 H GLN A 930 -27.348 8.407 8.369 1.00 0.00 H ATOM 1145 N ALA A 931 -28.959 5.540 8.547 1.00 10.78 N ATOM 1146 CA ALA A 931 -30.028 4.555 8.568 1.00 8.86 C ATOM 1147 C ALA A 931 -30.376 4.118 7.144 1.00 10.51 C ATOM 1148 O ALA A 931 -30.575 2.928 6.874 1.00 10.60 O ATOM 1149 CB ALA A 931 -31.252 5.119 9.273 1.00 10.33 C ATOM 1150 H ALA A 931 -29.133 6.492 8.927 1.00 0.00 H ATOM 1151 N LEU A 932 -30.439 5.080 6.232 1.00 10.79 N ATOM 1152 CA LEU A 932 -30.766 4.759 4.854 1.00 10.70 C ATOM 1153 C LEU A 932 -29.642 3.972 4.178 1.00 11.24 C ATOM 1154 O LEU A 932 -29.910 3.000 3.464 1.00 13.80 O ATOM 1155 CB LEU A 932 -31.095 6.041 4.076 1.00 10.31 C ATOM 1156 CG LEU A 932 -32.406 6.688 4.525 1.00 11.51 C ATOM 1157 CD1 LEU A 932 -32.532 8.099 3.951 1.00 13.63 C ATOM 1158 CD2 LEU A 932 -33.610 5.834 4.126 1.00 12.33 C ATOM 1159 H LEU A 932 -30.254 6.066 6.505 1.00 0.00 H ATOM 1160 N GLU A 933 -28.391 4.360 4.424 1.00 11.63 N ATOM 1161 CA GLU A 933 -27.253 3.647 3.837 1.00 11.82 C ATOM 1162 C GLU A 933 -27.188 2.195 4.333 1.00 12.29 C ATOM 1163 O GLU A 933 -26.915 1.262 3.564 1.00 13.68 O ATOM 1164 CB GLU A 933 -25.946 4.381 4.151 1.00 12.66 C ATOM 1165 CG GLU A 933 -24.676 3.662 3.661 1.00 14.75 C ATOM 1166 CD GLU A 933 -24.677 3.388 2.163 1.00 22.25 C ATOM 1167 OE1 GLU A 933 -25.252 4.194 1.400 1.00 22.62 O ATOM 1168 OE2 GLU A 933 -24.092 2.364 1.743 1.00 27.38 O ATOM 1169 H GLU A 933 -28.220 5.180 5.041 1.00 0.00 H ATOM 1170 N THR A 934 -27.470 2.005 5.613 1.00 13.02 N ATOM 1171 CA THR A 934 -27.423 0.682 6.225 1.00 10.71 C ATOM 1172 C THR A 934 -28.568 -0.204 5.753 1.00 13.85 C ATOM 1173 O THR A 934 -28.410 -1.423 5.629 1.00 18.10 O ATOM 1174 CB THR A 934 -27.444 0.804 7.759 1.00 12.43 C ATOM 1175 OG1 THR A 934 -26.237 1.445 8.172 1.00 14.76 O ATOM 1176 CG2 THR A 934 -27.535 -0.573 8.431 1.00 13.41 C ATOM 1177 HG1 THR A 934 -26.184 2.343 7.759 1.00 0.00 H ATOM 1178 H THR A 934 -27.733 2.823 6.199 1.00 0.00 H ATOM 1179 N GLY A 935 -29.721 0.403 5.487 1.00 11.53 N ATOM 1180 CA GLY A 935 -30.849 -0.337 4.965 1.00 10.93 C ATOM 1181 C GLY A 935 -31.783 -0.898 6.017 1.00 11.04 C ATOM 1182 O GLY A 935 -32.500 -1.857 5.751 1.00 10.95 O ATOM 1183 H GLY A 935 -29.813 1.425 5.657 1.00 0.00 H ATOM 1184 N VAL A 936 -31.802 -0.306 7.208 1.00 10.41 N ATOM 1185 CA VAL A 936 -32.775 -0.740 8.205 1.00 8.59 C ATOM 1186 C VAL A 936 -34.201 -0.490 7.701 1.00 9.70 C ATOM 1187 O VAL A 936 -34.437 0.414 6.878 1.00 10.52 O ATOM 1188 CB VAL A 936 -32.578 -0.016 9.565 1.00 7.90 C ATOM 1189 CG1 VAL A 936 -31.208 -0.352 10.156 1.00 9.71 C ATOM 1190 CG2 VAL A 936 -32.761 1.506 9.422 1.00 9.59 C ATOM 1191 H VAL A 936 -31.131 0.458 7.426 1.00 0.00 H ATOM 1192 N THR A 937 -35.147 -1.295 8.179 1.00 9.43 N ATOM 1193 CA THR A 937 -36.558 -1.025 7.905 1.00 7.99 C ATOM 1194 C THR A 937 -37.262 -0.419 9.116 1.00 8.71 C ATOM 1195 O THR A 937 -38.416 0.001 9.021 1.00 8.97 O ATOM 1196 CB THR A 937 -37.302 -2.300 7.486 1.00 9.15 C ATOM 1197 OG1 THR A 937 -37.319 -3.206 8.593 1.00 11.83 O ATOM 1198 CG2 THR A 937 -36.614 -2.960 6.276 1.00 11.50 C ATOM 1199 HG1 THR A 937 -37.797 -4.033 8.334 1.00 0.00 H ATOM 1200 H THR A 937 -34.881 -2.122 8.751 1.00 0.00 H ATOM 1201 N VAL A 938 -36.560 -0.361 10.247 1.00 8.64 N ATOM 1202 CA VAL A 938 -37.073 0.298 11.449 1.00 7.53 C ATOM 1203 C VAL A 938 -35.997 1.229 11.989 1.00 7.43 C ATOM 1204 O VAL A 938 -34.861 0.794 12.205 1.00 9.59 O ATOM 1205 CB VAL A 938 -37.471 -0.721 12.532 1.00 7.10 C ATOM 1206 CG1 VAL A 938 -37.850 -0.001 13.847 1.00 9.81 C ATOM 1207 CG2 VAL A 938 -38.619 -1.571 12.043 1.00 9.14 C ATOM 1208 H VAL A 938 -35.617 -0.798 10.277 1.00 0.00 H ATOM 1209 N THR A 939 -36.338 2.511 12.138 1.00 7.67 N ATOM 1210 CA THR A 939 -35.462 3.455 12.821 1.00 7.72 C ATOM 1211 C THR A 939 -36.278 4.060 13.961 1.00 8.14 C ATOM 1212 O THR A 939 -37.172 3.395 14.490 1.00 8.21 O ATOM 1213 CB THR A 939 -34.897 4.515 11.843 1.00 9.49 C ATOM 1214 OG1 THR A 939 -33.917 5.326 12.510 1.00 8.91 O ATOM 1215 CG2 THR A 939 -35.998 5.373 11.199 1.00 10.12 C ATOM 1216 HG1 THR A 939 -33.562 6.000 11.877 1.00 0.00 H ATOM 1217 H THR A 939 -37.248 2.843 11.759 1.00 0.00 H ATOM 1218 N GLY A 940 -35.968 5.282 14.377 1.00 8.36 N ATOM 1219 CA GLY A 940 -36.747 5.882 15.446 1.00 8.42 C ATOM 1220 C GLY A 940 -36.012 7.061 16.030 1.00 7.43 C ATOM 1221 O GLY A 940 -35.143 7.637 15.386 1.00 9.46 O ATOM 1222 H GLY A 940 -35.179 5.802 13.944 1.00 0.00 H ATOM 1223 N CYS A 941 -36.376 7.420 17.257 1.00 7.59 N ATOM 1224 CA CYS A 941 -35.700 8.507 17.942 1.00 8.66 C ATOM 1225 C CYS A 941 -35.536 8.155 19.414 1.00 7.75 C ATOM 1226 O CYS A 941 -36.202 7.252 19.942 1.00 8.55 O ATOM 1227 CB CYS A 941 -36.461 9.823 17.785 1.00 9.47 C ATOM 1228 SG CYS A 941 -38.217 9.711 18.262 1.00 10.80 S ATOM 1229 H CYS A 941 -37.153 6.917 17.731 1.00 0.00 H ATOM 1230 N THR A 942 -34.629 8.881 20.054 1.00 7.74 N ATOM 1231 CA THR A 942 -34.217 8.629 21.435 1.00 8.58 C ATOM 1232 C THR A 942 -34.082 9.933 22.198 1.00 9.36 C ATOM 1233 O THR A 942 -33.448 10.863 21.706 1.00 10.34 O ATOM 1234 CB THR A 942 -32.848 7.917 21.467 1.00 8.35 C ATOM 1235 OG1 THR A 942 -32.923 6.695 20.715 1.00 8.53 O ATOM 1236 CG2 THR A 942 -32.400 7.613 22.907 1.00 10.23 C ATOM 1237 HG1 THR A 942 -33.166 6.900 19.777 1.00 0.00 H ATOM 1238 H THR A 942 -34.186 9.673 19.546 1.00 0.00 H ATOM 1239 N VAL A 943 -34.656 9.990 23.403 1.00 7.93 N ATOM 1240 CA VAL A 943 -34.310 11.045 24.348 1.00 8.54 C ATOM 1241 C VAL A 943 -33.420 10.432 25.409 1.00 10.53 C ATOM 1242 O VAL A 943 -33.759 9.391 25.981 1.00 10.56 O ATOM 1243 CB VAL A 943 -35.545 11.686 25.007 1.00 8.95 C ATOM 1244 CG1 VAL A 943 -35.111 12.774 25.987 1.00 10.17 C ATOM 1245 CG2 VAL A 943 -36.472 12.260 23.955 1.00 11.90 C ATOM 1246 H VAL A 943 -35.359 9.272 23.671 1.00 0.00 H ATOM 1247 N HIS A 944 -32.272 11.057 25.655 1.00 9.43 N ATOM 1248 CA HIS A 944 -31.319 10.521 26.614 1.00 9.65 C ATOM 1249 C HIS A 944 -30.721 11.622 27.473 1.00 12.07 C ATOM 1250 O HIS A 944 -30.694 12.793 27.078 1.00 11.21 O ATOM 1251 CB HIS A 944 -30.198 9.761 25.890 1.00 10.50 C ATOM 1252 CG HIS A 944 -29.372 10.620 24.980 1.00 10.26 C ATOM 1253 ND1 HIS A 944 -28.190 11.202 25.381 1.00 13.07 N ATOM 1254 CD2 HIS A 944 -29.565 11.006 23.695 1.00 12.41 C ATOM 1255 CE1 HIS A 944 -27.684 11.899 24.379 1.00 13.78 C ATOM 1256 NE2 HIS A 944 -28.498 11.797 23.344 1.00 13.67 N ATOM 1257 H HIS A 944 -32.053 11.942 25.154 1.00 0.00 H ATOM 1258 N PHE A 945 -30.256 11.246 28.661 1.00 10.35 N ATOM 1259 CA PHE A 945 -29.440 12.157 29.451 1.00 11.66 C ATOM 1260 C PHE A 945 -28.126 12.385 28.727 1.00 13.36 C ATOM 1261 O PHE A 945 -27.566 11.458 28.134 1.00 14.68 O ATOM 1262 CB PHE A 945 -29.173 11.602 30.850 1.00 12.91 C ATOM 1263 CG PHE A 945 -30.347 11.712 31.783 1.00 13.34 C ATOM 1264 CD1 PHE A 945 -30.744 12.952 32.268 1.00 16.38 C ATOM 1265 CD2 PHE A 945 -31.030 10.581 32.200 1.00 12.66 C ATOM 1266 CE1 PHE A 945 -31.818 13.062 33.150 1.00 14.40 C ATOM 1267 CE2 PHE A 945 -32.115 10.690 33.083 1.00 13.03 C ATOM 1268 CZ PHE A 945 -32.496 11.930 33.552 1.00 14.91 C ATOM 1269 H PHE A 945 -30.476 10.298 29.027 1.00 0.00 H ATOM 1270 N VAL A 946 -27.628 13.612 28.784 1.00 12.86 N ATOM 1271 CA VAL A 946 -26.371 13.940 28.117 1.00 13.76 C ATOM 1272 C VAL A 946 -25.179 13.569 28.993 1.00 14.63 C ATOM 1273 O VAL A 946 -25.058 14.033 30.130 1.00 15.64 O ATOM 1274 CB VAL A 946 -26.328 15.433 27.747 1.00 12.90 C ATOM 1275 CG1 VAL A 946 -24.946 15.836 27.232 1.00 15.37 C ATOM 1276 CG2 VAL A 946 -27.396 15.730 26.707 1.00 12.97 C ATOM 1277 H VAL A 946 -28.138 14.350 29.310 1.00 0.00 H ATOM 1278 N ALA A 947 -24.322 12.697 28.456 1.00 16.29 N ATOM 1279 CA ALA A 947 -23.057 12.317 29.090 1.00 17.95 C ATOM 1280 C ALA A 947 -21.919 12.899 28.257 1.00 18.89 C ATOM 1281 O ALA A 947 -22.168 13.441 27.184 1.00 19.52 O ATOM 1282 CB ALA A 947 -22.944 10.807 29.195 1.00 19.68 C ATOM 1283 H ALA A 947 -24.565 12.266 27.541 1.00 0.00 H ATOM 1284 N GLU A 948 -20.682 12.801 28.740 1.00 20.98 N ATOM 1285 CA GLU A 948 -19.571 13.417 28.018 1.00 21.54 C ATOM 1286 C GLU A 948 -19.422 12.807 26.631 1.00 22.34 C ATOM 1287 O GLU A 948 -19.293 13.528 25.643 1.00 23.25 O ATOM 1288 CB GLU A 948 -18.256 13.293 28.791 1.00 24.40 C ATOM 1289 CG GLU A 948 -17.073 13.825 27.994 1.00 26.69 C ATOM 1290 CD GLU A 948 -15.909 14.272 28.856 1.00 34.29 C ATOM 1291 OE1 GLU A 948 -15.813 13.824 30.018 1.00 37.33 O ATOM 1292 OE2 GLU A 948 -15.088 15.077 28.363 1.00 35.27 O ATOM 1293 H GLU A 948 -20.507 12.288 29.628 1.00 0.00 H ATOM 1294 N ASP A 949 -19.457 11.481 26.553 1.00 22.62 N ATOM 1295 CA ASP A 949 -19.417 10.812 25.259 1.00 23.20 C ATOM 1296 C ASP A 949 -20.733 11.024 24.528 1.00 22.34 C ATOM 1297 O ASP A 949 -21.807 10.695 25.042 1.00 21.11 O ATOM 1298 CB ASP A 949 -19.128 9.322 25.418 1.00 27.23 C ATOM 1299 CG ASP A 949 -17.685 9.050 25.778 1.00 32.47 C ATOM 1300 OD1 ASP A 949 -16.809 9.825 25.344 1.00 35.33 O ATOM 1301 OD2 ASP A 949 -17.430 8.063 26.497 1.00 38.35 O ATOM 1302 H ASP A 949 -19.513 10.915 27.424 1.00 0.00 H ATOM 1303 N VAL A 950 -20.633 11.570 23.323 1.00 21.57 N ATOM 1304 CA VAL A 950 -21.805 11.974 22.550 1.00 20.08 C ATOM 1305 C VAL A 950 -22.723 10.801 22.218 1.00 19.37 C ATOM 1306 O VAL A 950 -22.268 9.746 21.773 1.00 20.94 O ATOM 1307 CB VAL A 950 -21.383 12.698 21.250 1.00 21.22 C ATOM 1308 CG1 VAL A 950 -22.587 12.999 20.369 1.00 22.78 C ATOM 1309 CG2 VAL A 950 -20.640 13.990 21.592 1.00 25.68 C ATOM 1310 H VAL A 950 -19.688 11.715 22.915 1.00 0.00 H ATOM 1311 N ASP A 951 -24.013 10.996 22.489 1.00 16.62 N ATOM 1312 CA ASP A 951 -25.073 10.037 22.169 1.00 14.89 C ATOM 1313 C ASP A 951 -24.919 8.718 22.926 1.00 17.21 C ATOM 1314 O ASP A 951 -25.449 7.686 22.501 1.00 19.27 O ATOM 1315 CB ASP A 951 -25.131 9.790 20.650 1.00 18.53 C ATOM 1316 CG ASP A 951 -25.539 11.036 19.874 1.00 20.20 C ATOM 1317 OD1 ASP A 951 -26.113 11.971 20.488 1.00 20.29 O ATOM 1318 OD2 ASP A 951 -25.302 11.084 18.652 1.00 21.79 O ATOM 1319 H ASP A 951 -24.284 11.884 22.957 1.00 0.00 H ATOM 1320 N ALA A 952 -24.225 8.762 24.063 1.00 18.83 N ATOM 1321 CA ALA A 952 -23.970 7.563 24.857 1.00 17.96 C ATOM 1322 C ALA A 952 -24.594 7.602 26.254 1.00 16.87 C ATOM 1323 O ALA A 952 -24.508 6.624 26.995 1.00 19.28 O ATOM 1324 CB ALA A 952 -22.460 7.324 24.975 1.00 22.00 C ATOM 1325 H ALA A 952 -23.855 9.676 24.394 1.00 0.00 H ATOM 1326 N GLY A 953 -25.229 8.715 26.615 1.00 13.86 N ATOM 1327 CA GLY A 953 -25.838 8.846 27.926 1.00 13.03 C ATOM 1328 C GLY A 953 -27.076 7.979 28.109 1.00 13.13 C ATOM 1329 O GLY A 953 -27.572 7.362 27.153 1.00 15.45 O ATOM 1330 H GLY A 953 -25.290 9.507 25.944 1.00 0.00 H ATOM 1331 N GLN A 954 -27.584 7.954 29.337 1.00 14.28 N ATOM 1332 CA GLN A 954 -28.661 7.044 29.715 1.00 13.38 C ATOM 1333 C GLN A 954 -29.967 7.338 28.988 1.00 14.43 C ATOM 1334 O GLN A 954 -30.454 8.466 28.978 1.00 12.80 O ATOM 1335 CB GLN A 954 -28.873 7.102 31.220 1.00 15.32 C ATOM 1336 CG GLN A 954 -27.802 6.362 31.977 1.00 20.42 C ATOM 1337 CD GLN A 954 -28.050 4.870 31.947 1.00 23.82 C ATOM 1338 OE1 GLN A 954 -28.950 4.371 32.620 1.00 23.32 O ATOM 1339 NE2 GLN A 954 -27.281 4.157 31.145 1.00 21.59 N ATOM 1340 HE22 GLN A 954 -26.531 4.622 30.594 1.00 0.00 H ATOM 1341 HE21 GLN A 954 -27.425 3.130 31.064 1.00 0.00 H ATOM 1342 H GLN A 954 -27.201 8.605 30.053 1.00 0.00 H ATOM 1343 N ILE A 955 -30.523 6.305 28.369 1.00 12.82 N ATOM 1344 CA ILE A 955 -31.745 6.450 27.586 1.00 10.48 C ATOM 1345 C ILE A 955 -32.970 6.598 28.482 1.00 10.87 C ATOM 1346 O ILE A 955 -33.155 5.836 29.435 1.00 12.25 O ATOM 1347 CB ILE A 955 -31.903 5.241 26.648 1.00 10.01 C ATOM 1348 CG1 ILE A 955 -30.791 5.273 25.588 1.00 10.65 C ATOM 1349 CG2 ILE A 955 -33.279 5.243 25.976 1.00 10.01 C ATOM 1350 CD1 ILE A 955 -30.657 3.975 24.772 1.00 12.15 C ATOM 1351 H ILE A 955 -30.077 5.369 28.444 1.00 0.00 H ATOM 1352 N ILE A 956 -33.804 7.586 28.170 1.00 9.58 N ATOM 1353 CA ILE A 956 -35.043 7.831 28.912 1.00 9.02 C ATOM 1354 C ILE A 956 -36.261 7.260 28.170 1.00 11.42 C ATOM 1355 O ILE A 956 -37.006 6.444 28.722 1.00 11.56 O ATOM 1356 CB ILE A 956 -35.243 9.341 29.170 1.00 9.40 C ATOM 1357 CG1 ILE A 956 -34.044 9.907 29.943 1.00 12.20 C ATOM 1358 CG2 ILE A 956 -36.536 9.587 29.923 1.00 11.01 C ATOM 1359 CD1 ILE A 956 -33.984 11.419 29.972 1.00 13.32 C ATOM 1360 H ILE A 956 -33.568 8.207 27.370 1.00 0.00 H ATOM 1361 N LEU A 957 -36.466 7.685 26.922 1.00 8.60 N ATOM 1362 CA LEU A 957 -37.551 7.157 26.088 1.00 8.19 C ATOM 1363 C LEU A 957 -37.071 6.973 24.655 1.00 8.71 C ATOM 1364 O LEU A 957 -36.123 7.635 24.215 1.00 9.26 O ATOM 1365 CB LEU A 957 -38.766 8.087 26.076 1.00 9.03 C ATOM 1366 CG LEU A 957 -39.560 8.294 27.365 1.00 10.49 C ATOM 1367 CD1 LEU A 957 -40.659 9.313 27.104 1.00 10.81 C ATOM 1368 CD2 LEU A 957 -40.139 6.972 27.853 1.00 12.31 C ATOM 1369 H LEU A 957 -35.837 8.413 26.528 1.00 0.00 H ATOM 1370 N GLN A 958 -37.732 6.077 23.936 1.00 8.16 N ATOM 1371 CA GLN A 958 -37.456 5.855 22.520 1.00 7.66 C ATOM 1372 C GLN A 958 -38.772 5.563 21.838 1.00 8.86 C ATOM 1373 O GLN A 958 -39.726 5.127 22.491 1.00 10.42 O ATOM 1374 CB GLN A 958 -36.495 4.679 22.304 1.00 7.58 C ATOM 1375 CG GLN A 958 -35.106 4.907 22.885 1.00 7.91 C ATOM 1376 CD GLN A 958 -34.170 3.731 22.630 1.00 9.94 C ATOM 1377 OE1 GLN A 958 -34.372 2.632 23.152 1.00 9.33 O ATOM 1378 NE2 GLN A 958 -33.149 3.960 21.812 1.00 9.45 N ATOM 1379 HE22 GLN A 958 -33.018 4.904 21.395 1.00 0.00 H ATOM 1380 HE21 GLN A 958 -32.480 3.196 21.589 1.00 0.00 H ATOM 1381 H GLN A 958 -38.474 5.512 24.397 1.00 0.00 H ATOM 1382 N GLU A 959 -38.838 5.809 20.531 1.00 7.70 N ATOM 1383 CA GLU A 959 -40.012 5.419 19.754 1.00 8.39 C ATOM 1384 C GLU A 959 -39.541 4.956 18.393 1.00 8.48 C ATOM 1385 O GLU A 959 -38.793 5.663 17.715 1.00 9.42 O ATOM 1386 CB GLU A 959 -41.026 6.571 19.613 1.00 9.36 C ATOM 1387 CG GLU A 959 -42.235 6.190 18.758 1.00 9.65 C ATOM 1388 CD GLU A 959 -43.352 7.231 18.747 1.00 18.74 C ATOM 1389 OE1 GLU A 959 -43.434 8.046 19.683 1.00 19.19 O ATOM 1390 OE2 GLU A 959 -44.163 7.222 17.795 1.00 17.76 O ATOM 1391 H GLU A 959 -38.044 6.285 20.057 1.00 0.00 H ATOM 1392 N ALA A 960 -39.979 3.766 18.003 1.00 7.80 N ATOM 1393 CA ALA A 960 -39.671 3.221 16.684 1.00 7.80 C ATOM 1394 C ALA A 960 -40.525 3.837 15.591 1.00 8.54 C ATOM 1395 O ALA A 960 -41.716 4.129 15.791 1.00 10.96 O ATOM 1396 CB ALA A 960 -39.855 1.704 16.689 1.00 9.21 C ATOM 1397 H ALA A 960 -40.560 3.204 18.657 1.00 0.00 H ATOM 1398 N VAL A 961 -39.910 4.010 14.425 1.00 7.88 N ATOM 1399 CA VAL A 961 -40.528 4.599 13.250 1.00 8.88 C ATOM 1400 C VAL A 961 -40.123 3.782 12.026 1.00 8.25 C ATOM 1401 O VAL A 961 -38.937 3.514 11.835 1.00 9.11 O ATOM 1402 CB VAL A 961 -40.072 6.065 13.068 1.00 8.06 C ATOM 1403 CG1 VAL A 961 -40.630 6.639 11.790 1.00 9.82 C ATOM 1404 CG2 VAL A 961 -40.481 6.934 14.271 1.00 9.66 C ATOM 1405 H VAL A 961 -38.919 3.703 14.349 1.00 0.00 H ATOM 1406 N PRO A 962 -41.088 3.391 11.179 1.00 8.53 N ATOM 1407 CA PRO A 962 -40.707 2.571 10.028 1.00 9.12 C ATOM 1408 C PRO A 962 -39.975 3.374 8.975 1.00 9.99 C ATOM 1409 O PRO A 962 -40.230 4.573 8.827 1.00 10.27 O ATOM 1410 CB PRO A 962 -42.047 2.095 9.478 1.00 10.86 C ATOM 1411 CG PRO A 962 -43.003 3.186 9.864 1.00 13.32 C ATOM 1412 CD PRO A 962 -42.544 3.623 11.235 1.00 10.85 C ATOM 1413 N VAL A 963 -39.076 2.701 8.266 1.00 8.65 N ATOM 1414 CA VAL A 963 -38.482 3.243 7.045 1.00 9.56 C ATOM 1415 C VAL A 963 -39.282 2.700 5.888 1.00 11.39 C ATOM 1416 O VAL A 963 -39.497 1.489 5.794 1.00 12.58 O ATOM 1417 CB VAL A 963 -37.012 2.831 6.878 1.00 9.93 C ATOM 1418 CG1 VAL A 963 -36.461 3.399 5.580 1.00 11.00 C ATOM 1419 CG2 VAL A 963 -36.184 3.309 8.050 1.00 11.14 C ATOM 1420 H VAL A 963 -38.785 1.757 8.590 1.00 0.00 H ATOM 1421 N LYS A 964 -39.742 3.587 5.013 1.00 11.00 N ATOM 1422 CA LYS A 964 -40.481 3.159 3.839 1.00 11.14 C ATOM 1423 C LYS A 964 -39.540 3.066 2.654 1.00 14.11 C ATOM 1424 O LYS A 964 -38.590 3.842 2.541 1.00 14.34 O ATOM 1425 CB LYS A 964 -41.627 4.127 3.543 1.00 13.70 C ATOM 1426 CG LYS A 964 -42.721 4.083 4.594 1.00 21.60 C ATOM 1427 CD LYS A 964 -43.868 5.017 4.232 1.00 33.27 C ATOM 1428 CE LYS A 964 -45.100 4.686 5.060 1.00 40.83 C ATOM 1429 NZ LYS A 964 -44.741 3.905 6.284 1.00 42.63 N ATOM 1430 HZ1 LYS A 964 -44.282 3.015 6.004 1.00 0.00 H ATOM 1431 HZ2 LYS A 964 -44.088 4.463 6.871 1.00 0.00 H ATOM 1432 HZ3 LYS A 964 -45.604 3.696 6.826 1.00 0.00 H ATOM 1433 H LYS A 964 -39.571 4.601 5.171 1.00 0.00 H ATOM 1434 N ARG A 965 -39.793 2.116 1.766 1.00 15.64 N ATOM 1435 CA ARG A 965 -38.953 1.987 0.591 1.00 16.70 C ATOM 1436 C ARG A 965 -39.070 3.240 -0.265 1.00 15.31 C ATOM 1437 O ARG A 965 -40.161 3.768 -0.468 1.00 17.83 O ATOM 1438 CB ARG A 965 -39.323 0.728 -0.180 1.00 21.08 C ATOM 1439 CG ARG A 965 -39.156 -0.499 0.701 1.00 21.63 C ATOM 1440 CD ARG A 965 -39.375 -1.786 -0.048 1.00 22.22 C ATOM 1441 NE ARG A 965 -40.774 -2.022 -0.385 1.00 23.87 N ATOM 1442 CZ ARG A 965 -41.711 -2.385 0.488 1.00 23.76 C ATOM 1443 NH1 ARG A 965 -41.424 -2.534 1.784 1.00 14.32 N ATOM 1444 NH2 ARG A 965 -42.951 -2.584 0.061 1.00 27.98 N ATOM 1445 HE ARG A 965 -41.060 -1.898 -1.377 1.00 0.00 H ATOM 1446 HH12 ARG A 965 -42.169 -2.818 2.452 1.00 0.00 H ATOM 1447 HH11 ARG A 965 -40.456 -2.366 2.125 1.00 0.00 H ATOM 1448 HH22 ARG A 965 -43.693 -2.868 0.732 1.00 0.00 H ATOM 1449 HH21 ARG A 965 -43.181 -2.456 -0.945 1.00 0.00 H ATOM 1450 H ARG A 965 -40.591 1.465 1.911 1.00 0.00 H ATOM 1451 N GLY A 966 -37.922 3.740 -0.705 1.00 14.48 N ATOM 1452 CA GLY A 966 -37.870 4.994 -1.433 1.00 13.82 C ATOM 1453 C GLY A 966 -37.674 6.208 -0.546 1.00 12.32 C ATOM 1454 O GLY A 966 -37.571 7.328 -1.063 1.00 14.04 O ATOM 1455 H GLY A 966 -37.039 3.221 -0.524 1.00 0.00 H ATOM 1456 N ASP A 967 -37.614 6.006 0.775 1.00 11.17 N ATOM 1457 CA ASP A 967 -37.418 7.141 1.680 1.00 9.95 C ATOM 1458 C ASP A 967 -36.147 7.903 1.352 1.00 9.97 C ATOM 1459 O ASP A 967 -35.143 7.333 0.882 1.00 13.19 O ATOM 1460 CB ASP A 967 -37.337 6.699 3.147 1.00 9.68 C ATOM 1461 CG ASP A 967 -38.668 6.806 3.895 1.00 11.52 C ATOM 1462 OD1 ASP A 967 -39.612 7.495 3.444 1.00 12.49 O ATOM 1463 OD2 ASP A 967 -38.740 6.205 4.984 1.00 11.05 O ATOM 1464 H ASP A 967 -37.706 5.044 1.159 1.00 0.00 H ATOM 1465 N THR A 968 -36.202 9.192 1.636 1.00 10.07 N ATOM 1466 CA THR A 968 -35.035 10.053 1.601 1.00 10.59 C ATOM 1467 C THR A 968 -34.862 10.649 2.978 1.00 11.54 C ATOM 1468 O THR A 968 -35.733 10.480 3.847 1.00 10.79 O ATOM 1469 CB THR A 968 -35.211 11.177 0.602 1.00 11.53 C ATOM 1470 OG1 THR A 968 -36.322 11.988 1.020 1.00 12.21 O ATOM 1471 CG2 THR A 968 -35.479 10.624 -0.788 1.00 12.95 C ATOM 1472 HG1 THR A 968 -36.450 12.728 0.375 1.00 0.00 H ATOM 1473 H THR A 968 -37.120 9.607 1.895 1.00 0.00 H ATOM 1474 N VAL A 969 -33.769 11.374 3.190 1.00 10.19 N ATOM 1475 CA VAL A 969 -33.644 12.132 4.430 1.00 9.83 C ATOM 1476 C VAL A 969 -34.868 13.027 4.630 1.00 10.12 C ATOM 1477 O VAL A 969 -35.396 13.113 5.736 1.00 11.28 O ATOM 1478 CB VAL A 969 -32.358 12.969 4.441 1.00 10.78 C ATOM 1479 CG1 VAL A 969 -32.363 13.963 5.585 1.00 11.24 C ATOM 1480 CG2 VAL A 969 -31.144 12.036 4.544 1.00 13.01 C ATOM 1481 H VAL A 969 -33.010 11.401 2.479 1.00 0.00 H ATOM 1482 N ALA A 970 -35.339 13.671 3.560 1.00 9.19 N ATOM 1483 CA ALA A 970 -36.524 14.534 3.672 1.00 9.37 C ATOM 1484 C ALA A 970 -37.748 13.793 4.228 1.00 11.47 C ATOM 1485 O ALA A 970 -38.398 14.257 5.178 1.00 10.98 O ATOM 1486 CB ALA A 970 -36.855 15.130 2.316 1.00 10.19 C ATOM 1487 H ALA A 970 -34.865 13.562 2.641 1.00 0.00 H ATOM 1488 N THR A 971 -38.080 12.647 3.644 1.00 9.52 N ATOM 1489 CA THR A 971 -39.317 11.977 4.049 1.00 8.63 C ATOM 1490 C THR A 971 -39.138 11.212 5.358 1.00 10.64 C ATOM 1491 O THR A 971 -40.064 11.172 6.178 1.00 10.41 O ATOM 1492 CB THR A 971 -39.838 11.026 2.949 1.00 10.16 C ATOM 1493 OG1 THR A 971 -38.850 10.033 2.660 1.00 10.92 O ATOM 1494 CG2 THR A 971 -40.155 11.806 1.673 1.00 11.57 C ATOM 1495 HG1 THR A 971 -38.658 9.512 3.480 1.00 0.00 H ATOM 1496 H THR A 971 -37.471 12.232 2.910 1.00 0.00 H ATOM 1497 N LEU A 972 -37.961 10.620 5.564 1.00 8.66 N ATOM 1498 CA LEU A 972 -37.712 9.897 6.811 1.00 8.19 C ATOM 1499 C LEU A 972 -37.626 10.848 8.003 1.00 9.21 C ATOM 1500 O LEU A 972 -38.211 10.565 9.056 1.00 9.44 O ATOM 1501 CB LEU A 972 -36.435 9.046 6.698 1.00 8.20 C ATOM 1502 CG LEU A 972 -36.128 8.187 7.929 1.00 7.64 C ATOM 1503 CD1 LEU A 972 -37.296 7.259 8.260 1.00 9.19 C ATOM 1504 CD2 LEU A 972 -34.864 7.372 7.672 1.00 9.11 C ATOM 1505 H LEU A 972 -37.219 10.672 4.837 1.00 0.00 H ATOM 1506 N SER A 973 -36.919 11.970 7.851 1.00 8.71 N ATOM 1507 CA SER A 973 -36.801 12.913 8.963 1.00 8.25 C ATOM 1508 C SER A 973 -38.175 13.454 9.337 1.00 9.27 C ATOM 1509 O SER A 973 -38.475 13.628 10.518 1.00 9.81 O ATOM 1510 CB SER A 973 -35.844 14.065 8.622 1.00 9.60 C ATOM 1511 OG SER A 973 -36.340 14.868 7.569 1.00 10.63 O ATOM 1512 HG SER A 973 -36.458 14.312 6.759 1.00 0.00 H ATOM 1513 H SER A 973 -36.453 12.173 6.944 1.00 0.00 H ATOM 1514 N GLU A 974 -39.015 13.692 8.336 1.00 9.34 N ATOM 1515 CA GLU A 974 -40.364 14.182 8.575 1.00 10.12 C ATOM 1516 C GLU A 974 -41.165 13.191 9.426 1.00 10.68 C ATOM 1517 O GLU A 974 -41.846 13.578 10.386 1.00 11.23 O ATOM 1518 CB GLU A 974 -41.054 14.434 7.238 1.00 10.50 C ATOM 1519 CG GLU A 974 -42.498 14.867 7.327 1.00 11.97 C ATOM 1520 CD GLU A 974 -43.033 15.182 5.959 1.00 12.55 C ATOM 1521 OE1 GLU A 974 -43.105 14.249 5.129 1.00 14.18 O ATOM 1522 OE2 GLU A 974 -43.352 16.364 5.707 1.00 13.93 O ATOM 1523 H GLU A 974 -38.701 13.524 7.359 1.00 0.00 H ATOM 1524 N ARG A 975 -41.051 11.905 9.099 1.00 8.95 N ATOM 1525 CA ARG A 975 -41.794 10.883 9.827 1.00 8.50 C ATOM 1526 C ARG A 975 -41.256 10.735 11.239 1.00 9.59 C ATOM 1527 O ARG A 975 -42.035 10.610 12.197 1.00 10.25 O ATOM 1528 CB ARG A 975 -41.735 9.536 9.095 1.00 8.69 C ATOM 1529 CG ARG A 975 -42.846 8.562 9.521 1.00 8.88 C ATOM 1530 CD ARG A 975 -42.744 7.207 8.794 1.00 9.73 C ATOM 1531 NE ARG A 975 -42.787 7.475 7.359 1.00 9.18 N ATOM 1532 CZ ARG A 975 -41.764 7.313 6.527 1.00 9.66 C ATOM 1533 NH1 ARG A 975 -40.627 6.766 6.945 1.00 9.11 N ATOM 1534 NH2 ARG A 975 -41.901 7.673 5.254 1.00 10.69 N ATOM 1535 HE ARG A 975 -43.684 7.818 6.959 1.00 0.00 H ATOM 1536 HH12 ARG A 975 -39.834 6.645 6.283 1.00 0.00 H ATOM 1537 HH11 ARG A 975 -40.530 6.459 7.934 1.00 0.00 H ATOM 1538 HH22 ARG A 975 -41.109 7.552 4.591 1.00 0.00 H ATOM 1539 HH21 ARG A 975 -42.800 8.075 4.921 1.00 0.00 H ATOM 1540 H ARG A 975 -40.425 11.627 8.316 1.00 0.00 H ATOM 1541 N VAL A 976 -39.932 10.744 11.374 1.00 8.68 N ATOM 1542 CA VAL A 976 -39.328 10.581 12.692 1.00 8.24 C ATOM 1543 C VAL A 976 -39.610 11.790 13.589 1.00 9.85 C ATOM 1544 O VAL A 976 -39.786 11.612 14.793 1.00 9.86 O ATOM 1545 CB VAL A 976 -37.808 10.325 12.586 1.00 7.67 C ATOM 1546 CG1 VAL A 976 -37.145 10.340 13.977 1.00 8.70 C ATOM 1547 CG2 VAL A 976 -37.562 8.970 11.915 1.00 9.13 C ATOM 1548 H VAL A 976 -39.326 10.868 10.538 1.00 0.00 H ATOM 1549 N LYS A 977 -39.701 12.995 13.019 1.00 10.17 N ATOM 1550 CA LYS A 977 -40.008 14.172 13.836 1.00 9.86 C ATOM 1551 C LYS A 977 -41.373 14.070 14.513 1.00 10.18 C ATOM 1552 O LYS A 977 -41.542 14.591 15.607 1.00 10.03 O ATOM 1553 CB LYS A 977 -39.928 15.451 12.990 1.00 9.37 C ATOM 1554 CG LYS A 977 -38.489 15.920 12.851 1.00 13.76 C ATOM 1555 CD LYS A 977 -38.382 17.293 12.229 1.00 21.73 C ATOM 1556 CE LYS A 977 -36.941 17.775 12.222 1.00 30.51 C ATOM 1557 NZ LYS A 977 -36.170 17.229 11.076 1.00 40.78 N ATOM 1558 HZ1 LYS A 977 -36.163 16.190 11.128 1.00 0.00 H ATOM 1559 HZ2 LYS A 977 -36.615 17.530 10.186 1.00 0.00 H ATOM 1560 HZ3 LYS A 977 -35.194 17.586 11.115 1.00 0.00 H ATOM 1561 H LYS A 977 -39.554 13.098 11.995 1.00 0.00 H ATOM 1562 N LEU A 978 -42.338 13.388 13.891 1.00 8.75 N ATOM 1563 CA LEU A 978 -43.644 13.208 14.530 1.00 10.70 C ATOM 1564 C LEU A 978 -43.476 12.469 15.856 1.00 11.55 C ATOM 1565 O LEU A 978 -44.145 12.779 16.847 1.00 11.46 O ATOM 1566 CB LEU A 978 -44.607 12.447 13.613 1.00 10.75 C ATOM 1567 CG LEU A 978 -44.987 13.209 12.340 1.00 15.55 C ATOM 1568 CD1 LEU A 978 -45.943 12.392 11.494 1.00 18.44 C ATOM 1569 CD2 LEU A 978 -45.574 14.566 12.685 1.00 15.89 C ATOM 1570 H LEU A 978 -42.162 12.983 12.949 1.00 0.00 H ATOM 1571 N ALA A 979 -42.574 11.496 15.872 1.00 9.70 N ATOM 1572 CA ALA A 979 -42.307 10.732 17.088 1.00 8.95 C ATOM 1573 C ALA A 979 -41.481 11.559 18.073 1.00 9.01 C ATOM 1574 O ALA A 979 -41.695 11.473 19.291 1.00 9.89 O ATOM 1575 CB ALA A 979 -41.589 9.423 16.744 1.00 10.87 C ATOM 1576 H ALA A 979 -42.048 11.273 15.003 1.00 0.00 H ATOM 1577 N GLU A 980 -40.533 12.338 17.556 1.00 8.79 N ATOM 1578 CA GLU A 980 -39.705 13.191 18.418 1.00 8.86 C ATOM 1579 C GLU A 980 -40.600 14.098 19.243 1.00 10.21 C ATOM 1580 O GLU A 980 -40.369 14.302 20.443 1.00 10.40 O ATOM 1581 CB GLU A 980 -38.730 14.041 17.599 1.00 8.47 C ATOM 1582 CG GLU A 980 -37.683 13.227 16.853 1.00 8.45 C ATOM 1583 CD GLU A 980 -36.719 14.105 16.092 1.00 16.26 C ATOM 1584 OE1 GLU A 980 -36.395 15.196 16.592 1.00 17.55 O ATOM 1585 OE2 GLU A 980 -36.286 13.710 14.990 1.00 17.14 O ATOM 1586 H GLU A 980 -40.377 12.342 16.528 1.00 0.00 H ATOM 1587 N HIS A 981 -41.628 14.641 18.592 1.00 9.95 N ATOM 1588 CA HIS A 981 -42.536 15.592 19.233 1.00 9.53 C ATOM 1589 C HIS A 981 -43.433 14.949 20.279 1.00 10.40 C ATOM 1590 O HIS A 981 -44.099 15.644 21.039 1.00 12.20 O ATOM 1591 CB HIS A 981 -43.393 16.275 18.181 1.00 11.01 C ATOM 1592 CG HIS A 981 -42.592 17.022 17.174 1.00 12.23 C ATOM 1593 ND1 HIS A 981 -43.102 17.404 15.951 1.00 14.20 N ATOM 1594 CD2 HIS A 981 -41.306 17.445 17.199 1.00 12.97 C ATOM 1595 CE1 HIS A 981 -42.163 18.032 15.266 1.00 14.46 C ATOM 1596 NE2 HIS A 981 -41.065 18.073 15.999 1.00 14.65 N ATOM 1597 H HIS A 981 -41.790 14.381 17.598 1.00 0.00 H ATOM 1598 N LYS A 982 -43.461 13.619 20.292 1.00 10.64 N ATOM 1599 CA LYS A 982 -44.162 12.873 21.330 1.00 10.83 C ATOM 1600 C LYS A 982 -43.235 12.595 22.507 1.00 11.31 C ATOM 1601 O LYS A 982 -43.541 12.936 23.659 1.00 12.67 O ATOM 1602 CB LYS A 982 -44.707 11.554 20.769 1.00 10.62 C ATOM 1603 CG LYS A 982 -45.836 11.723 19.759 1.00 13.77 C ATOM 1604 CD LYS A 982 -46.050 10.451 18.928 1.00 14.49 C ATOM 1605 CE LYS A 982 -46.430 9.248 19.785 1.00 17.05 C ATOM 1606 NZ LYS A 982 -46.737 8.028 18.952 1.00 17.87 N ATOM 1607 HZ1 LYS A 982 -47.533 8.236 18.315 1.00 0.00 H ATOM 1608 HZ2 LYS A 982 -45.899 7.773 18.391 1.00 0.00 H ATOM 1609 HZ3 LYS A 982 -46.990 7.237 19.578 1.00 0.00 H ATOM 1610 H LYS A 982 -42.968 13.096 19.540 1.00 0.00 H ATOM 1611 N ILE A 983 -42.096 11.966 22.229 1.00 9.28 N ATOM 1612 CA ILE A 983 -41.248 11.500 23.331 1.00 7.65 C ATOM 1613 C ILE A 983 -40.471 12.612 24.019 1.00 9.92 C ATOM 1614 O ILE A 983 -40.193 12.484 25.204 1.00 10.80 O ATOM 1615 CB ILE A 983 -40.270 10.356 22.922 1.00 8.75 C ATOM 1616 CG1 ILE A 983 -39.240 10.776 21.874 1.00 7.71 C ATOM 1617 CG2 ILE A 983 -41.053 9.114 22.468 1.00 11.02 C ATOM 1618 CD1 ILE A 983 -38.094 9.753 21.772 1.00 10.18 C ATOM 1619 H ILE A 983 -41.810 11.807 21.242 1.00 0.00 H ATOM 1620 N PHE A 984 -40.131 13.709 23.341 1.00 10.05 N ATOM 1621 CA PHE A 984 -39.341 14.719 24.053 1.00 10.07 C ATOM 1622 C PHE A 984 -40.198 15.403 25.127 1.00 10.52 C ATOM 1623 O PHE A 984 -39.765 15.455 26.284 1.00 9.65 O ATOM 1624 CB PHE A 984 -38.678 15.672 23.044 1.00 10.62 C ATOM 1625 CG PHE A 984 -37.452 16.377 23.569 1.00 10.41 C ATOM 1626 CD1 PHE A 984 -36.940 16.119 24.838 1.00 12.13 C ATOM 1627 CD2 PHE A 984 -36.673 17.113 22.687 1.00 11.99 C ATOM 1628 CE1 PHE A 984 -35.748 16.740 25.269 1.00 12.03 C ATOM 1629 CE2 PHE A 984 -35.481 17.705 23.098 1.00 14.30 C ATOM 1630 CZ PHE A 984 -35.017 17.516 24.385 1.00 13.27 C ATOM 1631 H PHE A 984 -40.414 13.843 22.349 1.00 0.00 H ATOM 1632 N PRO A 985 -41.425 15.843 24.796 1.00 10.02 N ATOM 1633 CA PRO A 985 -42.290 16.351 25.872 1.00 11.31 C ATOM 1634 C PRO A 985 -42.542 15.336 26.986 1.00 9.61 C ATOM 1635 O PRO A 985 -42.564 15.709 28.168 1.00 11.02 O ATOM 1636 CB PRO A 985 -43.601 16.678 25.145 1.00 13.50 C ATOM 1637 CG PRO A 985 -43.161 17.039 23.752 1.00 12.50 C ATOM 1638 CD PRO A 985 -42.035 16.057 23.466 1.00 9.50 C ATOM 1639 N ALA A 986 -42.753 14.071 26.625 1.00 9.01 N ATOM 1640 CA ALA A 986 -43.013 13.060 27.639 1.00 10.46 C ATOM 1641 C ALA A 986 -41.792 12.888 28.547 1.00 11.38 C ATOM 1642 O ALA A 986 -41.930 12.824 29.770 1.00 11.27 O ATOM 1643 CB ALA A 986 -43.396 11.732 26.985 1.00 11.13 C ATOM 1644 H ALA A 986 -42.732 13.806 25.619 1.00 0.00 H ATOM 1645 N ALA A 987 -40.601 12.823 27.950 1.00 9.99 N ATOM 1646 CA ALA A 987 -39.374 12.672 28.740 1.00 9.66 C ATOM 1647 C ALA A 987 -39.137 13.865 29.652 1.00 9.03 C ATOM 1648 O ALA A 987 -38.738 13.704 30.800 1.00 9.59 O ATOM 1649 CB ALA A 987 -38.180 12.473 27.831 1.00 11.05 C ATOM 1650 H ALA A 987 -40.542 12.880 26.913 1.00 0.00 H ATOM 1651 N LEU A 988 -39.353 15.073 29.138 1.00 9.83 N ATOM 1652 CA LEU A 988 -39.185 16.268 29.961 1.00 9.50 C ATOM 1653 C LEU A 988 -40.125 16.234 31.168 1.00 10.21 C ATOM 1654 O LEU A 988 -39.724 16.573 32.283 1.00 10.31 O ATOM 1655 CB LEU A 988 -39.437 17.533 29.138 1.00 9.42 C ATOM 1656 CG LEU A 988 -39.398 18.825 29.968 1.00 9.93 C ATOM 1657 CD1 LEU A 988 -38.076 18.934 30.727 1.00 11.95 C ATOM 1658 CD2 LEU A 988 -39.623 20.037 29.079 1.00 10.25 C ATOM 1659 H LEU A 988 -39.643 15.167 28.144 1.00 0.00 H ATOM 1660 N GLN A 989 -41.370 15.811 30.951 1.00 9.71 N ATOM 1661 CA GLN A 989 -42.311 15.725 32.067 1.00 10.47 C ATOM 1662 C GLN A 989 -41.850 14.683 33.094 1.00 9.88 C ATOM 1663 O GLN A 989 -41.932 14.924 34.306 1.00 11.57 O ATOM 1664 CB GLN A 989 -43.719 15.397 31.556 1.00 10.79 C ATOM 1665 CG GLN A 989 -44.744 15.203 32.675 1.00 13.97 C ATOM 1666 CD GLN A 989 -44.946 16.427 33.561 1.00 17.77 C ATOM 1667 OE1 GLN A 989 -44.704 17.573 33.155 1.00 14.62 O ATOM 1668 NE2 GLN A 989 -45.390 16.180 34.800 1.00 18.98 N ATOM 1669 HE22 GLN A 989 -45.580 15.202 35.099 1.00 0.00 H ATOM 1670 HE21 GLN A 989 -45.545 16.966 35.463 1.00 0.00 H ATOM 1671 H GLN A 989 -41.671 15.543 29.992 1.00 0.00 H ATOM 1672 N LEU A 990 -41.353 13.546 32.615 1.00 11.73 N ATOM 1673 CA LEU A 990 -40.842 12.518 33.530 1.00 11.63 C ATOM 1674 C LEU A 990 -39.710 13.029 34.406 1.00 11.90 C ATOM 1675 O LEU A 990 -39.673 12.755 35.601 1.00 13.61 O ATOM 1676 CB LEU A 990 -40.368 11.293 32.749 1.00 11.42 C ATOM 1677 CG LEU A 990 -41.480 10.467 32.113 1.00 13.30 C ATOM 1678 CD1 LEU A 990 -40.883 9.435 31.173 1.00 15.59 C ATOM 1679 CD2 LEU A 990 -42.321 9.792 33.201 1.00 17.22 C ATOM 1680 H LEU A 990 -41.326 13.385 31.588 1.00 0.00 H ATOM 1681 N VAL A 991 -38.790 13.789 33.830 1.00 10.07 N ATOM 1682 CA VAL A 991 -37.659 14.289 34.604 1.00 11.67 C ATOM 1683 C VAL A 991 -38.081 15.467 35.498 1.00 13.79 C ATOM 1684 O VAL A 991 -37.724 15.528 36.686 1.00 13.84 O ATOM 1685 CB VAL A 991 -36.484 14.685 33.663 1.00 11.86 C ATOM 1686 CG1 VAL A 991 -35.343 15.344 34.455 1.00 12.95 C ATOM 1687 CG2 VAL A 991 -35.982 13.450 32.892 1.00 15.14 C ATOM 1688 H VAL A 991 -38.875 14.030 32.822 1.00 0.00 H ATOM 1689 N ALA A 992 -38.871 16.391 34.951 1.00 11.59 N ATOM 1690 CA ALA A 992 -39.282 17.571 35.707 1.00 11.98 C ATOM 1691 C ALA A 992 -40.133 17.212 36.931 1.00 12.14 C ATOM 1692 O ALA A 992 -40.093 17.904 37.961 1.00 14.36 O ATOM 1693 CB ALA A 992 -40.044 18.551 34.795 1.00 11.83 C ATOM 1694 H ALA A 992 -39.199 16.270 33.972 1.00 0.00 H ATOM 1695 N SER A 993 -40.904 16.137 36.813 1.00 13.51 N ATOM 1696 CA SER A 993 -41.767 15.705 37.902 1.00 14.29 C ATOM 1697 C SER A 993 -41.016 14.856 38.925 1.00 15.23 C ATOM 1698 O SER A 993 -41.571 14.501 39.967 1.00 17.09 O ATOM 1699 CB SER A 993 -42.941 14.900 37.353 1.00 14.35 C ATOM 1700 OG SER A 993 -42.487 13.673 36.810 1.00 16.87 O ATOM 1701 HG SER A 993 -41.848 13.855 36.076 1.00 0.00 H ATOM 1702 H SER A 993 -40.891 15.594 35.926 1.00 0.00 H ATOM 1703 N GLY A 994 -39.781 14.495 38.604 1.00 16.36 N ATOM 1704 CA GLY A 994 -38.989 13.635 39.472 1.00 17.38 C ATOM 1705 C GLY A 994 -39.315 12.157 39.337 1.00 18.51 C ATOM 1706 O GLY A 994 -38.850 11.337 40.129 1.00 22.39 O ATOM 1707 H GLY A 994 -39.369 14.834 37.712 1.00 0.00 H ATOM 1708 N THR A 995 -40.114 11.807 38.337 1.00 15.80 N ATOM 1709 CA THR A 995 -40.499 10.414 38.120 1.00 16.22 C ATOM 1710 C THR A 995 -39.303 9.599 37.640 1.00 18.19 C ATOM 1711 O THR A 995 -39.123 8.439 38.019 1.00 19.29 O ATOM 1712 CB THR A 995 -41.653 10.321 37.108 1.00 18.42 C ATOM 1713 OG1 THR A 995 -42.783 11.047 37.618 1.00 18.91 O ATOM 1714 CG2 THR A 995 -42.056 8.876 36.862 1.00 17.61 C ATOM 1715 HG1 THR A 995 -42.532 11.995 37.752 1.00 0.00 H ATOM 1716 H THR A 995 -40.474 12.540 37.693 1.00 0.00 H ATOM 1717 N VAL A 996 -38.483 10.231 36.809 1.00 15.81 N ATOM 1718 CA VAL A 996 -37.278 9.615 36.284 1.00 16.80 C ATOM 1719 C VAL A 996 -36.081 10.457 36.695 1.00 16.65 C ATOM 1720 O VAL A 996 -36.112 11.678 36.554 1.00 19.01 O ATOM 1721 CB VAL A 996 -37.332 9.495 34.750 1.00 18.03 C ATOM 1722 CG1 VAL A 996 -35.950 9.293 34.173 1.00 20.58 C ATOM 1723 CG2 VAL A 996 -38.256 8.361 34.353 1.00 18.25 C ATOM 1724 H VAL A 996 -38.713 11.204 36.523 1.00 0.00 H ATOM 1725 N GLN A 997 -35.041 9.813 37.219 1.00 17.89 N ATOM 1726 CA GLN A 997 -33.804 10.518 37.495 1.00 18.64 C ATOM 1727 C GLN A 997 -32.629 9.646 37.105 1.00 21.84 C ATOM 1728 O GLN A 997 -32.758 8.433 36.928 1.00 20.64 O ATOM 1729 CB GLN A 997 -33.708 10.933 38.971 1.00 22.83 C ATOM 1730 CG GLN A 997 -33.517 9.793 39.950 1.00 28.79 C ATOM 1731 CD GLN A 997 -33.346 10.280 41.384 1.00 33.74 C ATOM 1732 OE1 GLN A 997 -34.262 10.857 41.964 1.00 36.46 O ATOM 1733 NE2 GLN A 997 -32.170 10.046 41.958 1.00 36.00 N ATOM 1734 HE22 GLN A 997 -31.422 9.554 41.429 1.00 0.00 H ATOM 1735 HE21 GLN A 997 -31.998 10.355 42.936 1.00 0.00 H ATOM 1736 H GLN A 997 -35.116 8.798 37.432 1.00 0.00 H ATOM 1737 N LEU A 998 -31.481 10.282 36.958 1.00 21.12 N ATOM 1738 CA LEU A 998 -30.252 9.564 36.726 1.00 25.29 C ATOM 1739 C LEU A 998 -29.794 9.010 38.068 1.00 30.18 C ATOM 1740 O LEU A 998 -29.559 9.762 39.009 1.00 30.58 O ATOM 1741 CB LEU A 998 -29.208 10.488 36.108 1.00 24.48 C ATOM 1742 CG LEU A 998 -27.943 9.848 35.570 1.00 28.47 C ATOM 1743 CD1 LEU A 998 -28.319 8.693 34.653 1.00 29.70 C ATOM 1744 CD2 LEU A 998 -27.150 10.900 34.834 1.00 28.20 C ATOM 1745 H LEU A 998 -31.463 11.321 37.011 1.00 0.00 H ATOM 1746 N GLY A 999 -29.703 7.691 38.168 1.00 37.04 N ATOM 1747 CA GLY A 999 -29.298 7.070 39.412 1.00 43.43 C ATOM 1748 C GLY A 999 -27.837 7.320 39.742 1.00 49.35 C ATOM 1749 O GLY A 999 -27.012 7.559 38.856 1.00 48.24 O ATOM 1750 H GLY A 999 -29.925 7.096 37.344 1.00 0.00 H ATOM 1751 N GLU A1000 -27.531 7.271 41.033 1.00 52.83 N ATOM 1752 CA GLU A1000 -26.168 7.399 41.537 1.00 58.37 C ATOM 1753 C GLU A1000 -25.225 6.371 40.909 1.00 58.20 C ATOM 1754 O GLU A1000 -24.048 6.649 40.676 1.00 57.52 O ATOM 1755 CB GLU A1000 -26.179 7.252 43.055 1.00 63.82 C ATOM 1756 CG GLU A1000 -27.394 6.481 43.548 1.00 68.41 C ATOM 1757 CD GLU A1000 -27.549 6.508 45.055 1.00 75.66 C ATOM 1758 OE1 GLU A1000 -26.724 7.158 45.733 1.00 78.24 O ATOM 1759 OE2 GLU A1000 -28.501 5.874 45.563 1.00 77.73 O ATOM 1760 H GLU A1000 -28.301 7.135 41.719 1.00 0.00 H ATOM 1761 N ASN A1001 -25.758 5.185 40.629 1.00 57.98 N ATOM 1762 CA ASN A1001 -25.009 4.138 39.943 1.00 56.74 C ATOM 1763 C ASN A1001 -24.917 4.406 38.442 1.00 54.52 C ATOM 1764 O ASN A1001 -24.462 3.559 37.673 1.00 53.51 O ATOM 1765 CB ASN A1001 -25.654 2.773 40.199 1.00 55.41 C ATOM 1766 CG ASN A1001 -26.992 2.618 39.502 1.00 54.71 C ATOM 1767 OD1 ASN A1001 -27.669 3.604 39.193 1.00 53.24 O ATOM 1768 ND2 ASN A1001 -27.388 1.375 39.262 1.00 54.66 N ATOM 1769 HD22 ASN A1001 -26.785 0.574 39.540 1.00 0.00 H ATOM 1770 HD21 ASN A1001 -28.301 1.201 38.796 1.00 0.00 H ATOM 1771 H ASN A1001 -26.742 4.998 40.909 1.00 0.00 H ATOM 1772 N GLY A1002 -25.373 5.586 38.034 1.00 53.76 N ATOM 1773 CA GLY A1002 -25.284 6.008 36.651 1.00 51.16 C ATOM 1774 C GLY A1002 -26.386 5.459 35.770 1.00 46.76 C ATOM 1775 O GLY A1002 -26.458 5.795 34.593 1.00 45.04 O ATOM 1776 H GLY A1002 -25.807 6.226 38.729 1.00 0.00 H ATOM 1777 N LYS A1003 -27.240 4.611 36.333 1.00 43.78 N ATOM 1778 CA LYS A1003 -28.325 3.999 35.569 1.00 38.45 C ATOM 1779 C LYS A1003 -29.614 4.783 35.777 1.00 31.45 C ATOM 1780 O LYS A1003 -29.781 5.446 36.800 1.00 30.55 O ATOM 1781 CB LYS A1003 -28.521 2.530 35.964 1.00 40.22 C ATOM 1782 CG LYS A1003 -27.665 1.520 35.192 1.00 44.89 C ATOM 1783 CD LYS A1003 -26.333 2.100 34.737 1.00 48.62 C ATOM 1784 CE LYS A1003 -25.656 1.207 33.708 1.00 53.44 C ATOM 1785 NZ LYS A1003 -24.481 1.883 33.087 1.00 56.29 N ATOM 1786 HZ1 LYS A1003 -24.794 2.754 32.613 1.00 0.00 H ATOM 1787 HZ2 LYS A1003 -23.788 2.119 33.826 1.00 0.00 H ATOM 1788 HZ3 LYS A1003 -24.044 1.246 32.391 1.00 0.00 H ATOM 1789 H LYS A1003 -27.134 4.377 37.341 1.00 0.00 H ATOM 1790 N ILE A1004 -30.524 4.719 34.814 1.00 27.69 N ATOM 1791 CA ILE A1004 -31.778 5.451 34.960 1.00 24.68 C ATOM 1792 C ILE A1004 -32.609 4.840 36.101 1.00 23.93 C ATOM 1793 O ILE A1004 -32.608 3.622 36.311 1.00 25.81 O ATOM 1794 CB ILE A1004 -32.570 5.472 33.641 1.00 32.43 C ATOM 1795 CG1 ILE A1004 -33.507 6.676 33.601 1.00 37.13 C ATOM 1796 CG2 ILE A1004 -33.319 4.174 33.421 1.00 37.10 C ATOM 1797 CD1 ILE A1004 -34.384 6.704 32.376 1.00 36.57 C ATOM 1798 H ILE A1004 -30.345 4.151 33.961 1.00 0.00 H ATOM 1799 N CYS A1005 -33.266 5.705 36.870 1.00 21.31 N ATOM 1800 CA CYS A1005 -34.072 5.287 38.008 1.00 23.60 C ATOM 1801 C CYS A1005 -35.501 5.798 37.863 1.00 22.18 C ATOM 1802 O CYS A1005 -35.724 7.004 37.780 1.00 22.66 O ATOM 1803 CB CYS A1005 -33.457 5.802 39.320 1.00 26.06 C ATOM 1804 SG CYS A1005 -34.433 5.508 40.831 1.00 41.38 S ATOM 1805 H CYS A1005 -33.201 6.719 36.649 1.00 0.00 H ATOM 1806 N TRP A1006 -36.459 4.878 37.813 1.00 21.55 N ATOM 1807 CA TRP A1006 -37.871 5.239 37.855 1.00 20.77 C ATOM 1808 C TRP A1006 -38.345 5.157 39.291 1.00 25.58 C ATOM 1809 O TRP A1006 -38.287 4.096 39.913 1.00 26.54 O ATOM 1810 CB TRP A1006 -38.717 4.321 36.975 1.00 22.62 C ATOM 1811 CG TRP A1006 -38.621 4.594 35.512 1.00 21.25 C ATOM 1812 CD1 TRP A1006 -37.551 4.350 34.703 1.00 23.05 C ATOM 1813 CD2 TRP A1006 -39.647 5.134 34.671 1.00 21.70 C ATOM 1814 NE1 TRP A1006 -37.843 4.717 33.408 1.00 23.48 N ATOM 1815 CE2 TRP A1006 -39.126 5.198 33.364 1.00 22.71 C ATOM 1816 CE3 TRP A1006 -40.954 5.578 34.900 1.00 24.81 C ATOM 1817 CZ2 TRP A1006 -39.866 5.688 32.286 1.00 21.48 C ATOM 1818 CZ3 TRP A1006 -41.686 6.060 33.831 1.00 22.14 C ATOM 1819 CH2 TRP A1006 -41.143 6.107 32.542 1.00 21.59 C ATOM 1820 HE1 TRP A1006 -37.196 4.642 32.597 1.00 0.00 H ATOM 1821 H TRP A1006 -36.195 3.875 37.742 1.00 0.00 H ATOM 1822 N VAL A1007 -38.805 6.282 39.818 1.00 30.27 N ATOM 1823 CA VAL A1007 -39.237 6.352 41.209 1.00 43.30 C ATOM 1824 C VAL A1007 -40.700 5.949 41.357 1.00 48.22 C ATOM 1825 O VAL A1007 -41.010 4.788 41.634 1.00 53.05 O ATOM 1826 CB VAL A1007 -39.038 7.762 41.777 1.00 44.79 C ATOM 1827 CG1 VAL A1007 -39.619 7.844 43.168 1.00 47.43 C ATOM 1828 CG2 VAL A1007 -37.551 8.132 41.777 1.00 45.92 C ATOM 1829 H VAL A1007 -38.859 7.135 39.226 1.00 0.00 H TER 1830 VAL A1007 HETATM 1831 O HOH 1 -30.381 2.819 31.843 1.00 32.46 O HETATM 1832 O HOH 2 -26.251 23.642 13.086 1.00 30.57 O HETATM 1833 O HOH 3 -10.176 29.676 27.713 1.00 34.99 O HETATM 1834 O HOH 4 -19.619 35.865 26.454 1.00 42.99 O HETATM 1835 O HOH 5 -33.994 38.641 28.806 1.00 41.89 O HETATM 1836 O HOH 6 -50.826 20.816 24.019 1.00 39.56 O HETATM 1837 O HOH 7 -33.835 17.356 10.140 1.00 37.88 O HETATM 1838 O HOH 8 -46.442 16.275 21.719 1.00 27.47 O HETATM 1839 O HOH 9 -44.430 29.621 18.934 1.00 31.16 O HETATM 1840 O HOH 10 -40.860 -1.437 -2.912 1.00 39.09 O HETATM 1841 O HOH 11 -36.066 21.659 9.598 1.00 42.43 O HETATM 1842 O HOH 12 -33.723 26.887 40.027 1.00 20.76 O HETATM 1843 O HOH 13 -44.082 7.571 22.170 1.00 30.24 O HETATM 1844 O HOH 14 -29.036 -3.963 5.565 1.00 24.33 O HETATM 1845 O HOH 15 -31.773 1.916 1.973 1.00 29.47 O HETATM 1846 O HOH 16 -33.394 22.346 12.883 1.00 22.17 O HETATM 1847 O HOH 17 -44.009 19.008 31.062 1.00 17.36 O HETATM 1848 O HOH 18 -37.082 25.496 40.500 1.00 19.30 O HETATM 1849 O HOH 19 -33.112 7.648 11.548 1.00 12.09 O HETATM 1850 O HOH 20 -28.621 14.887 3.781 1.00 22.12 O HETATM 1851 O HOH 21 -36.979 8.141 -3.506 1.00 21.93 O HETATM 1852 O HOH 22 -16.515 23.488 30.688 1.00 33.83 O HETATM 1853 O HOH 23 -36.052 13.328 12.381 1.00 13.40 O HETATM 1854 O HOH 24 -34.205 4.987 0.089 1.00 28.22 O HETATM 1855 O HOH 25 -26.270 36.365 31.879 1.00 37.99 O HETATM 1856 O HOH 26 -29.128 40.026 31.658 1.00 50.96 O HETATM 1857 O HOH 27 -23.474 30.878 14.828 1.00 34.32 O HETATM 1858 O HOH 28 -31.815 22.716 40.177 1.00 30.82 O HETATM 1859 O HOH 29 -32.360 3.396 30.132 1.00 16.78 O HETATM 1860 O HOH 30 -16.914 16.926 25.366 1.00 37.95 O HETATM 1861 O HOH 31 -27.458 13.762 19.040 1.00 17.25 O HETATM 1862 O HOH 32 -37.546 13.338 -0.933 1.00 14.72 O HETATM 1863 O HOH 33 -44.005 5.519 15.716 1.00 23.24 O HETATM 1864 O HOH 34 -42.791 11.656 5.735 1.00 11.85 O HETATM 1865 O HOH 35 -36.208 22.320 18.307 1.00 14.08 O HETATM 1866 O HOH 36 -24.563 24.444 15.158 1.00 32.77 O HETATM 1867 O HOH 37 -20.119 23.511 23.005 1.00 31.84 O HETATM 1868 O HOH 38 -33.644 15.204 11.689 1.00 23.91 O HETATM 1869 O HOH 39 -31.337 17.306 18.862 1.00 17.65 O HETATM 1870 O HOH 40 -46.036 13.440 24.606 1.00 20.82 O HETATM 1871 O HOH 41 -55.235 20.172 36.560 1.00 17.54 O HETATM 1872 O HOH 42 -47.276 20.073 19.927 1.00 31.88 O HETATM 1873 O HOH 43 -46.420 14.246 16.722 1.00 19.03 O HETATM 1874 O HOH 44 -48.720 19.245 23.942 1.00 32.15 O HETATM 1875 O HOH 45 -36.193 26.178 9.144 1.00 37.61 O HETATM 1876 O HOH 46 -17.193 32.724 28.337 1.00 36.66 O HETATM 1877 O HOH 47 -38.294 33.727 31.695 1.00 21.88 O HETATM 1878 O HOH 48 -48.458 26.517 22.927 1.00 39.51 O HETATM 1879 O HOH 49 -35.497 13.966 37.892 1.00 27.56 O HETATM 1880 O HOH 50 -50.584 23.952 25.190 1.00 40.09 O HETATM 1881 O HOH 51 -24.331 11.409 25.873 1.00 14.84 O HETATM 1882 O HOH 52 -26.052 18.074 38.168 1.00 26.49 O HETATM 1883 O HOH 53 -29.591 18.691 20.213 1.00 17.32 O HETATM 1884 O HOH 54 -18.068 21.147 36.188 1.00 31.96 O HETATM 1885 O HOH 55 -25.602 34.661 35.558 1.00 31.44 O HETATM 1886 O HOH 56 -31.276 36.348 15.487 1.00 40.87 O HETATM 1887 O HOH 57 -45.016 17.846 7.295 1.00 23.13 O HETATM 1888 O HOH 58 -43.157 18.420 28.584 1.00 14.75 O HETATM 1889 O HOH 59 -32.929 2.329 5.610 1.00 17.76 O HETATM 1890 O HOH 60 -25.195 16.376 31.549 1.00 16.91 O HETATM 1891 O HOH 61 -39.779 -4.354 8.194 1.00 12.72 O HETATM 1892 O HOH 62 -31.120 -0.316 15.482 1.00 12.29 O HETATM 1893 O HOH 63 -22.102 6.153 13.493 1.00 28.98 O HETATM 1894 O HOH 64 -43.703 20.779 16.576 1.00 23.17 O HETATM 1895 O HOH 65 -35.806 -2.052 -4.396 1.00 36.36 O HETATM 1896 O HOH 66 -40.652 -1.608 9.137 1.00 18.71 O HETATM 1897 O HOH 67 -44.365 18.509 39.744 1.00 30.68 O HETATM 1898 O HOH 68 -30.785 21.883 14.087 1.00 23.92 O HETATM 1899 O HOH 69 -40.239 21.949 40.388 1.00 34.07 O HETATM 1900 O HOH 70 -25.927 12.293 32.120 1.00 23.07 O HETATM 1901 O HOH 71 -42.918 16.112 10.721 1.00 18.44 O HETATM 1902 O HOH 72 -45.798 16.834 15.627 1.00 21.31 O HETATM 1903 O HOH 73 -35.344 -0.015 4.288 1.00 15.65 O HETATM 1904 O HOH 74 -38.185 -0.249 4.062 1.00 17.71 O HETATM 1905 O HOH 75 -31.593 13.064 37.353 1.00 20.41 O HETATM 1906 O HOH 76 -17.289 14.526 23.949 1.00 36.32 O HETATM 1907 O HOH 77 -46.611 18.914 22.423 1.00 16.99 O HETATM 1908 O HOH 78 -32.477 1.301 13.570 1.00 12.97 O HETATM 1909 O HOH 79 -41.148 -0.579 6.690 1.00 21.47 O HETATM 1910 O HOH 80 -42.459 5.398 23.013 1.00 28.69 O HETATM 1911 O HOH 81 -23.297 34.742 28.360 1.00 22.90 O HETATM 1912 O HOH 82 -13.338 33.081 24.056 1.00 36.71 O HETATM 1913 O HOH 83 -20.428 7.633 21.788 1.00 40.62 O HETATM 1914 O HOH 84 -34.798 -2.394 2.870 1.00 16.19 O HETATM 1915 O HOH 85 -23.649 4.064 26.235 1.00 35.97 O HETATM 1916 O HOH 86 -52.056 25.935 31.785 1.00 26.49 O HETATM 1917 O HOH 87 -32.302 3.916 14.353 1.00 8.51 O HETATM 1918 O HOH 88 -41.376 29.568 12.687 1.00 30.02 O HETATM 1919 O HOH 89 -37.654 20.652 11.338 1.00 42.60 O HETATM 1920 O HOH 90 -35.453 2.481 -0.193 1.00 35.69 O HETATM 1921 O HOH 91 -44.125 8.909 13.031 1.00 18.14 O HETATM 1922 O HOH 92 -23.481 3.907 10.216 1.00 21.16 O HETATM 1923 O HOH 93 -41.134 17.959 6.443 1.00 16.47 O HETATM 1924 O HOH 94 -20.253 30.585 33.456 1.00 27.30 O HETATM 1925 O HOH 95 -17.940 11.659 22.208 1.00 39.80 O HETATM 1926 O HOH 96 -40.225 17.888 21.181 1.00 14.74 O HETATM 1927 O HOH 97 -37.537 17.327 8.330 1.00 26.30 O HETATM 1928 O HOH 98 -44.688 27.212 15.625 1.00 40.52 O HETATM 1929 O HOH 99 -33.007 38.137 33.384 1.00 41.98 O HETATM 1930 O HOH 100 -19.499 9.663 28.799 1.00 31.14 O HETATM 1931 O HOH 101 -23.529 20.407 39.617 1.00 35.09 O HETATM 1932 O HOH 102 -27.125 4.851 25.882 1.00 24.21 O HETATM 1933 O HOH 103 -37.970 33.630 34.451 1.00 28.78 O HETATM 1934 O HOH 104 -43.399 26.874 29.396 1.00 14.99 O HETATM 1935 O HOH 105 -41.186 7.579 1.060 1.00 27.43 O HETATM 1936 O HOH 106 -33.184 23.504 16.608 1.00 18.04 O HETATM 1937 O HOH 107 -27.585 15.151 32.101 1.00 15.20 O HETATM 1938 O HOH 108 -29.518 27.344 38.141 1.00 29.89 O HETATM 1939 O HOH 109 -47.622 10.336 15.093 1.00 37.35 O HETATM 1940 O HOH 110 -47.488 18.323 29.800 1.00 34.60 O HETATM 1941 O HOH 111 -41.079 25.493 38.302 1.00 12.40 O HETATM 1942 O HOH 112 -44.520 11.886 30.611 1.00 18.73 O HETATM 1943 O HOH 113 -24.114 3.448 23.629 1.00 26.50 O HETATM 1944 O HOH 114 -45.546 7.959 6.679 1.00 27.01 O HETATM 1945 O HOH 115 -36.793 4.349 30.748 1.00 15.68 O HETATM 1946 O HOH 116 -24.683 13.619 39.305 1.00 45.39 O HETATM 1947 O HOH 117 -27.612 5.770 0.857 1.00 25.06 O HETATM 1948 O HOH 118 -26.867 25.206 38.892 1.00 37.29 O HETATM 1949 O HOH 119 -19.115 24.465 20.692 1.00 25.91 O HETATM 1950 O HOH 120 -29.595 23.808 38.531 1.00 33.72 O HETATM 1951 O HOH 121 -25.221 33.058 13.840 1.00 37.18 O HETATM 1952 O HOH 122 -43.881 9.579 4.300 1.00 21.42 O HETATM 1953 O HOH 123 -44.952 9.097 15.710 1.00 22.18 O HETATM 1954 O HOH 124 -26.184 9.591 31.304 1.00 18.33 O HETATM 1955 O HOH 125 -34.323 28.048 10.703 1.00 32.19 O HETATM 1956 O HOH 126 -39.051 -2.758 3.471 1.00 15.84 O HETATM 1957 O HOH 127 -41.925 2.285 19.600 1.00 13.30 O HETATM 1958 O HOH 128 -37.612 -0.716 -3.457 1.00 37.78 O HETATM 1959 O HOH 129 -28.304 12.884 13.518 1.00 23.62 O HETATM 1960 O HOH 130 -20.439 11.767 31.486 1.00 28.15 O HETATM 1961 O HOH 131 -24.538 2.278 14.148 1.00 16.44 O HETATM 1962 O HOH 132 -24.406 3.701 7.671 1.00 25.83 O HETATM 1963 O HOH 133 -35.570 37.963 24.442 1.00 37.30 O HETATM 1964 O HOH 134 -52.745 19.246 31.762 1.00 16.79 O HETATM 1965 O HOH 135 -23.172 4.573 15.535 1.00 24.43 O HETATM 1966 O HOH 136 -42.135 0.413 2.426 1.00 23.09 O HETATM 1967 O HOH 137 -29.245 37.680 22.222 1.00 36.48 O HETATM 1968 O HOH 138 -28.487 1.519 1.023 1.00 40.89 O HETATM 1969 O HOH 139 -34.587 23.212 42.134 1.00 36.57 O HETATM 1970 O HOH 140 -42.131 3.348 22.184 1.00 31.10 O HETATM 1971 O HOH 141 -26.375 4.884 23.215 1.00 22.99 O HETATM 1972 O HOH 142 -12.263 23.764 21.815 1.00 37.70 O HETATM 1973 O HOH 143 -44.960 12.917 35.207 1.00 41.27 O HETATM 1974 O HOH 144 -35.685 3.018 1.990 1.00 33.60 O HETATM 1975 O HOH 145 -22.160 30.468 35.492 1.00 29.04 O HETATM 1976 O HOH 146 -36.905 17.556 38.919 1.00 34.20 O HETATM 1977 O HOH 147 -43.240 21.632 39.197 1.00 24.47 O HETATM 1978 O HOH 148 -29.299 12.754 8.264 1.00 14.54 O HETATM 1979 O HOH 149 -43.395 30.313 32.418 1.00 34.61 O HETATM 1980 O HOH 150 -29.305 4.097 0.355 1.00 37.06 O HETATM 1981 O HOH 151 -30.921 27.077 40.734 1.00 44.30 O HETATM 1982 O HOH 152 -24.276 0.041 18.075 1.00 36.41 O HETATM 1983 O HOH 153 -56.225 17.319 36.521 1.00 35.96 O HETATM 1984 O HOH 154 -46.076 14.820 27.096 1.00 31.29 O HETATM 1985 O HOH 155 -44.239 9.434 24.290 1.00 25.21 O HETATM 1986 O HOH 156 -35.747 27.946 41.655 1.00 39.38 O HETATM 1987 O HOH 157 -29.005 23.233 12.454 1.00 28.14 O HETATM 1988 O HOH 158 -18.854 33.935 30.315 1.00 32.65 O HETATM 1989 O HOH 159 -44.533 11.617 8.007 1.00 18.10 O HETATM 1990 O HOH 160 -31.786 4.087 0.489 1.00 29.22 O HETATM 1991 O HOH 161 -41.803 0.438 13.262 1.00 18.40 O HETATM 1992 O HOH 162 -43.193 31.259 14.612 1.00 38.50 O HETATM 1993 O HOH 163 -45.856 19.012 17.836 1.00 29.75 O HETATM 1994 O HOH 164 -46.623 10.893 24.702 1.00 44.72 O HETATM 1995 O HOH 165 -26.632 22.986 37.546 1.00 33.73 O HETATM 1996 O HOH 166 -41.781 23.539 12.456 1.00 37.40 O HETATM 1997 O HOH 167 -55.578 19.428 32.479 1.00 28.38 O HETATM 1998 O HOH 168 -33.706 2.049 3.072 1.00 30.30 O HETATM 1999 O HOH 169 -42.224 18.611 12.140 1.00 31.55 O HETATM 2000 O HOH 170 -40.076 20.189 10.678 1.00 32.50 O HETATM 2001 O HOH 171 -30.584 -0.186 0.962 1.00 37.42 O HETATM 2002 O HOH 172 -40.499 -3.331 5.717 1.00 16.83 O HETATM 2003 O HOH 173 -48.208 12.977 15.576 1.00 35.58 O HETATM 2004 O HOH 174 -47.661 15.257 18.966 1.00 36.73 O HETATM 2005 O HOH 175 -45.252 28.205 31.426 1.00 26.00 O HETATM 2006 O HOH 176 -56.659 20.955 30.114 1.00 39.01 O HETATM 2007 O HOH 177 -40.361 17.569 9.055 1.00 21.35 O HETATM 2008 O HOH 178 -23.546 6.396 6.207 1.00 37.25 O HETATM 2009 O HOH 179 -46.097 13.936 8.045 1.00 21.62 O HETATM 2010 O HOH 180 -35.799 19.911 38.716 1.00 35.95 O HETATM 2011 O HOH 181 -25.061 36.762 29.434 1.00 30.66 O HETATM 2012 O HOH 182 -43.285 9.409 1.652 1.00 34.63 O HETATM 2013 O HOH 183 -45.347 16.289 9.441 1.00 20.55 O HETATM 2014 O HOH 184 -23.746 1.611 11.696 1.00 24.96 O HETATM 2015 O HOH 185 -44.003 6.352 12.831 1.00 19.92 O HETATM 2016 O HOH 186 -46.378 9.729 8.522 1.00 27.96 O HETATM 2017 O HOH 187 -25.562 37.307 34.321 1.00 31.30 O HETATM 2018 O HOH 188 -43.350 23.366 14.511 1.00 33.37 O HETATM 2019 O HOH 189 -21.300 3.607 17.196 1.00 29.87 O HETATM 2020 O HOH 190 -44.954 25.156 14.441 1.00 40.35 O HETATM 2021 O HOH 191 -45.417 11.696 33.095 1.00 29.72 O HETATM 2022 O HOH 192 -20.691 35.547 28.881 1.00 28.55 O HETATM 2023 O HOH 193 -46.461 13.430 29.298 1.00 30.42 O HETATM 2024 O HOH 194 -42.497 -1.032 10.904 1.00 31.47 O HETATM 2025 O HOH 195 -47.019 17.701 13.240 1.00 43.64 O HETATM 2026 O HOH 196 -22.975 32.634 37.165 1.00 38.32 O HETATM 2027 O HOH 197 -45.732 5.356 10.889 1.00 34.95 O HETATM 2028 O HOH 198 -38.133 36.722 31.660 1.00 44.33 O HETATM 2029 O HOH 199 -44.200 7.679 26.422 1.00 35.13 O HETATM 2030 O HOH 200 -23.236 38.513 35.009 1.00 33.43 O HETATM 2031 O HOH 201 -20.772 38.101 29.951 1.00 33.30 O HETATM 2032 O HOH 202 -47.426 17.104 10.880 1.00 30.17 O HETATM 2033 O HOH 203 -48.638 13.280 8.982 1.00 35.77 O HETATM 2034 N1 UNN A 204 -22.371 16.952 23.890 1.00 -0.21 N HETATM 2035 C2 UNN A 204 -21.959 15.888 24.674 1.00 0.20 C HETATM 2036 N3 UNN A 204 -22.753 14.712 24.769 1.00 -0.26 N HETATM 2037 C4 UNN A 204 -23.909 14.564 24.016 1.00 0.22 C HETATM 2038 C8 UNN A 204 -24.340 15.589 23.237 1.00 0.16 C HETATM 2039 C7 UNN A 204 -25.406 15.912 22.358 1.00 0.04 C HETATM 2040 C6 UNN A 204 -25.253 17.084 21.879 1.00 0.14 C HETATM 2041 N5 UNN A 204 -24.212 17.577 22.345 1.00 -0.16 N HETATM 2042 C9 UNN A 204 -23.490 16.811 23.203 1.00 0.27 C HETATM 2043 H3 UNN A 204 -23.909 18.528 22.091 1.00 0.26 H HETATM 2044 C29 UNN A 204 -26.218 17.762 20.890 1.00 0.04 C HETATM 2045 C16 UNN A 204 -25.971 17.213 19.475 1.00 -0.03 C HETATM 2046 C15 UNN A 204 -24.490 17.378 19.080 1.00 -0.05 C HETATM 2047 C14 UNN A 204 -24.369 17.532 17.556 1.00 -0.05 C HETATM 2048 C13 UNN A 204 -22.968 17.075 17.078 1.00 -0.04 C HETATM 2049 C12 UNN A 204 -22.002 18.275 16.936 1.00 0.04 C HETATM 2050 C17 UNN A 204 -20.921 17.910 15.887 1.00 0.18 C HETATM 2051 O18 UNN A 204 -20.990 16.806 15.394 1.00 -0.40 O HETATM 2052 N19 UNN A 204 -19.835 18.772 15.444 1.00 -0.27 N HETATM 2053 C20 UNN A 204 -19.491 20.126 15.841 1.00 0.10 C HETATM 2054 C21 UNN A 204 -20.634 21.093 15.685 1.00 -0.01 C HETATM 2055 C22 UNN A 204 -20.827 21.546 14.242 1.00 0.00 C HETATM 2056 C23 UNN A 204 -22.112 22.349 14.173 1.00 0.04 C HETATM 2057 O24 UNN A 204 -23.186 21.787 13.823 1.00 -0.57 O HETATM 2058 O25 UNN A 204 -22.111 23.573 14.468 1.00 -0.57 O HETATM 2059 H21 UNN A 204 -20.898 20.669 13.582 1.00 0.04 H HETATM 2060 H22 UNN A 204 -19.978 22.172 13.930 1.00 0.04 H HETATM 2061 H19 UNN A 204 -20.435 21.977 16.308 1.00 0.03 H HETATM 2062 H20 UNN A 204 -21.558 20.604 16.027 1.00 0.03 H HETATM 2063 C26 UNN A 204 -18.966 20.194 17.254 1.00 0.06 C HETATM 2064 O27 UNN A 204 -17.820 19.758 17.516 1.00 -0.57 O HETATM 2065 O28 UNN A 204 -19.665 20.709 18.170 1.00 -0.57 O HETATM 2066 H18 UNN A 204 -18.684 20.459 15.171 1.00 0.07 H HETATM 2067 H17 UNN A 204 -19.230 18.368 14.758 1.00 0.19 H HETATM 2068 H7 UNN A 204 -21.524 18.484 17.904 1.00 0.05 H HETATM 2069 H8 UNN A 204 -22.559 19.163 16.602 1.00 0.05 H HETATM 2070 H9 UNN A 204 -22.553 16.366 17.810 1.00 0.03 H HETATM 2071 H10 UNN A 204 -23.067 16.578 16.102 1.00 0.03 H HETATM 2072 H11 UNN A 204 -25.138 16.916 17.067 1.00 0.03 H HETATM 2073 H12 UNN A 204 -24.518 18.588 17.285 1.00 0.03 H HETATM 2074 H13 UNN A 204 -24.079 18.273 19.571 1.00 0.03 H HETATM 2075 H14 UNN A 204 -23.925 16.491 19.403 1.00 0.03 H HETATM 2076 H15 UNN A 204 -26.235 16.145 19.450 1.00 0.03 H HETATM 2077 H16 UNN A 204 -26.600 17.763 18.759 1.00 0.03 H HETATM 2078 H23 UNN A 204 -26.047 18.849 20.897 1.00 0.07 H HETATM 2079 H24 UNN A 204 -27.256 17.553 21.189 1.00 0.07 H HETATM 2080 H4 UNN A 204 -26.239 15.251 22.125 1.00 0.07 H HETATM 2081 O10 UNN A 204 -24.503 13.504 24.135 1.00 -0.38 O HETATM 2082 H2 UNN A 204 -22.473 13.979 25.389 1.00 0.18 H HETATM 2083 N11 UNN A 204 -20.762 15.981 25.438 1.00 -0.33 N HETATM 2084 H5 UNN A 204 -20.178 16.827 25.379 1.00 0.18 H HETATM 2085 H6 UNN A 204 -20.480 15.202 26.050 1.00 0.18 H HETATM 2086 H1 UNN A 204 -21.824 17.823 23.844 1.00 0.24 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 2034 2035 2042 2086 CONECT 2035 2034 2036 2083 CONECT 2036 2035 2037 2082 CONECT 2037 2036 2038 2081 CONECT 2038 2037 2039 2042 CONECT 2039 2038 2040 2080 CONECT 2040 2039 2041 2044 CONECT 2041 2040 2042 2043 CONECT 2042 2034 2038 2041 CONECT 2043 2041 CONECT 2044 2040 2045 2078 2079 CONECT 2045 2044 2046 2076 2077 CONECT 2046 2045 2047 2074 2075 CONECT 2047 2046 2048 2072 2073 CONECT 2048 2047 2049 2070 2071 CONECT 2049 2048 2050 2068 2069 CONECT 2050 2049 2051 2052 CONECT 2051 2050 CONECT 2052 2050 2053 2067 CONECT 2053 2052 2054 2063 2066 CONECT 2054 2053 2055 2061 2062 CONECT 2055 2054 2056 2059 2060 CONECT 2056 2055 2057 2058 CONECT 2057 2056 CONECT 2058 2056 CONECT 2059 2055 CONECT 2060 2055 CONECT 2061 2054 CONECT 2062 2054 CONECT 2063 2053 2064 2065 CONECT 2064 2063 CONECT 2065 2063 CONECT 2066 2053 CONECT 2067 2052 CONECT 2068 2049 CONECT 2069 2049 CONECT 2070 2048 CONECT 2071 2048 CONECT 2072 2047 CONECT 2073 2047 CONECT 2074 2046 CONECT 2075 2046 CONECT 2076 2045 CONECT 2077 2045 CONECT 2078 2044 CONECT 2079 2044 CONECT 2080 2039 CONECT 2081 2037 CONECT 2082 2036 CONECT 2083 2035 2084 2085 CONECT 2084 2083 CONECT 2085 2083 CONECT 2086 2034 MASTER 0 0 0 0 0 0 0 0 2085 1 57 16 END
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4zyw
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210aa, >4ZYW_1|Chain... at 100%
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210aa, >4ZYY_1|Chain... at 100%
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4zz1
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210aa, >4ZZ1_1|Chain... at 100%
4zz2
RCSB PDB
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210aa, >4ZZ2_1|Chain... at 100%
4zz3
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PDBbind
210aa, >4ZZ3_1|Chain... at 100%
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4zyz
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
glycinamide ribonucleotide (GAR) formyltransferase
Ligand Name
3YD
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Ki=67nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Biochemistry Vol. 55: pp. 4574-4582
Ligand Properties
Formula
C
1
8
H
2
6
N
5
O
6
Molecular Weight
408.429
Exact Mass
408.188
No. of atoms
55
No. of bonds
56
Polar Surface Area
192.51
LOGP Value
3.68 (
Computed with XLOGP3
)
1.15 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 2
Canonical SMILES
O=C(N[C@H](C(=O)O)CCC(=O)O)CCCCCCc1[nH]c2c(c1)c(=O)[nH]c([nH+]2)N
InChI String
InChI=1S/C18H25N5O6/c19-18-22-15-11(16(27)23-18)9-10(20-15)5-3-1-2-4-6-13(24)21-12(17(28)29)7-8-14(25)26/h9,12H,1-8H2,(H,21,24)(H,25,26)(H,28,29)(H4,19,20,22,23,27)/p+1/t12-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P22102
Entrez Gene ID
NCBI Entrez Gene ID:
2618
ASD
Information of known allosteric effects of PDB entries
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