Browse entries in the PDBbind-CN Database
HEADER 5VWK_COMPLEX COMPND 5VWK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 102 ASN LEU LEU ILE GLU PRO ALA ARG ILE GLU GLU GLU GLU SEQRES 2 A 102 LEU THR LEU THR ILE LEU ARG GLN THR GLY GLY LEU GLY SEQRES 3 A 102 ILE SER ILE ALA GLY GLY LYS GLY SER THR PRO TYR LYS SEQRES 4 A 102 GLY ASP ASP GLU GLY ILE PHE ILE SER ARG VAL SER GLU SEQRES 5 A 102 GLU GLY PRO ALA ALA ARG ALA GLY VAL ARG VAL GLY ASP SEQRES 6 A 102 LYS LEU LEU GLU VAL ASN GLY VAL ALA LEU GLN GLY ALA SEQRES 7 A 102 GLU HIS HIS GLU ALA VAL GLU ALA LEU ARG GLY ALA GLY SEQRES 8 A 102 THR ALA VAL GLN MET ARG VAL TRP ARG GLU ARG HET PRO A 170 125 ATOM 1 N ASN A 714 -18.689 -9.367 -74.011 1.00 68.33 N ATOM 2 CA ASN A 714 -17.345 -9.096 -73.513 1.00 74.67 C ATOM 3 C ASN A 714 -17.000 -10.036 -72.359 1.00 69.73 C ATOM 4 O ASN A 714 -17.841 -10.310 -71.502 1.00 77.90 O ATOM 5 CB ASN A 714 -17.225 -7.638 -73.061 1.00 64.02 C ATOM 6 HN3 ASN A 714 -19.377 -9.226 -73.244 1.00 0.00 H ATOM 7 HN2 ASN A 714 -18.741 -10.349 -74.349 1.00 0.00 H ATOM 8 HN1 ASN A 714 -18.904 -8.718 -74.795 1.00 0.00 H ATOM 9 N LEU A 715 -15.763 -10.532 -72.347 1.00 58.57 N ATOM 10 CA LEU A 715 -15.256 -11.375 -71.273 1.00 49.86 C ATOM 11 C LEU A 715 -14.120 -10.657 -70.556 1.00 50.27 C ATOM 12 O LEU A 715 -13.391 -9.858 -71.154 1.00 50.07 O ATOM 13 CB LEU A 715 -14.761 -12.722 -71.805 1.00 49.22 C ATOM 14 CG LEU A 715 -15.730 -13.473 -72.719 1.00 53.85 C ATOM 15 CD1 LEU A 715 -15.042 -14.675 -73.321 1.00 41.87 C ATOM 16 CD2 LEU A 715 -16.982 -13.899 -71.968 1.00 54.47 C ATOM 17 H LEU A 715 -15.131 -10.307 -73.141 1.00 0.00 H ATOM 18 N LEU A 716 -13.966 -10.955 -69.268 1.00 41.52 N ATOM 19 CA LEU A 716 -13.035 -10.214 -68.429 1.00 42.78 C ATOM 20 C LEU A 716 -11.616 -10.754 -68.558 1.00 44.35 C ATOM 21 O LEU A 716 -11.396 -11.966 -68.630 1.00 44.77 O ATOM 22 CB LEU A 716 -13.480 -10.270 -66.967 1.00 41.59 C ATOM 23 H LEU A 716 -14.521 -11.731 -68.853 1.00 0.00 H ATOM 24 N ILE A 717 -10.653 -9.838 -68.591 1.00 46.59 N ATOM 25 CA ILE A 717 -9.234 -10.170 -68.574 1.00 43.49 C ATOM 26 C ILE A 717 -8.739 -10.078 -67.139 1.00 43.96 C ATOM 27 O ILE A 717 -9.185 -9.220 -66.367 1.00 45.54 O ATOM 28 CB ILE A 717 -8.434 -9.233 -69.504 1.00 44.42 C ATOM 29 CG1 ILE A 717 -8.639 -9.620 -70.967 1.00 45.46 C ATOM 30 CG2 ILE A 717 -6.940 -9.269 -69.190 1.00 40.96 C ATOM 31 CD1 ILE A 717 -9.874 -9.041 -71.590 1.00 57.96 C ATOM 32 H ILE A 717 -10.926 -8.835 -68.631 1.00 0.00 H ATOM 33 N GLU A 718 -7.817 -10.959 -66.780 1.00 48.09 N ATOM 34 CA GLU A 718 -7.227 -10.913 -65.454 1.00 43.92 C ATOM 35 C GLU A 718 -6.492 -9.594 -65.270 1.00 42.54 C ATOM 36 O GLU A 718 -5.738 -9.180 -66.164 1.00 35.85 O ATOM 37 CB GLU A 718 -6.260 -12.077 -65.254 1.00 47.89 C ATOM 38 CG GLU A 718 -6.906 -13.448 -65.264 1.00 62.66 C ATOM 39 CD GLU A 718 -7.985 -13.587 -64.215 1.00 76.41 C ATOM 40 OE1 GLU A 718 -9.088 -14.066 -64.554 1.00 82.17 O ATOM 41 OE2 GLU A 718 -7.732 -13.208 -63.052 1.00 77.62 O ATOM 42 H GLU A 718 -7.513 -11.690 -67.454 1.00 0.00 H ATOM 43 N PRO A 719 -6.669 -8.902 -64.151 1.00 49.07 N ATOM 44 CA PRO A 719 -5.910 -7.679 -63.912 1.00 44.09 C ATOM 45 C PRO A 719 -4.475 -7.990 -63.522 1.00 35.64 C ATOM 46 O PRO A 719 -4.132 -9.108 -63.129 1.00 34.91 O ATOM 47 CB PRO A 719 -6.660 -7.016 -62.754 1.00 47.34 C ATOM 48 CG PRO A 719 -7.208 -8.172 -61.990 1.00 46.94 C ATOM 49 CD PRO A 719 -7.582 -9.202 -63.030 1.00 45.88 C ATOM 50 N ALA A 720 -3.634 -6.967 -63.639 1.00 37.13 N ATOM 51 CA ALA A 720 -2.269 -7.071 -63.148 1.00 35.83 C ATOM 52 C ALA A 720 -2.269 -7.632 -61.733 1.00 36.12 C ATOM 53 O ALA A 720 -3.191 -7.399 -60.945 1.00 37.06 O ATOM 54 CB ALA A 720 -1.584 -5.708 -63.178 1.00 38.99 C ATOM 55 H ALA A 720 -3.955 -6.084 -64.086 1.00 0.00 H ATOM 56 N ARG A 721 -1.221 -8.381 -61.409 1.00 37.84 N ATOM 57 CA ARG A 721 -1.238 -9.211 -60.210 1.00 37.17 C ATOM 58 C ARG A 721 0.188 -9.425 -59.727 1.00 37.71 C ATOM 59 O ARG A 721 1.025 -9.947 -60.473 1.00 31.70 O ATOM 60 CB ARG A 721 -1.928 -10.534 -60.526 1.00 41.31 C ATOM 61 CG ARG A 721 -1.650 -11.668 -59.566 1.00 48.97 C ATOM 62 CD ARG A 721 -2.738 -12.728 -59.677 1.00 61.78 C ATOM 63 NE ARG A 721 -2.370 -13.988 -59.038 1.00 81.24 N ATOM 64 CZ ARG A 721 -3.242 -14.915 -58.649 1.00 91.10 C ATOM 65 NH1 ARG A 721 -2.814 -16.032 -58.077 1.00 97.60 N ATOM 66 NH2 ARG A 721 -4.545 -14.723 -58.817 1.00 93.76 N ATOM 67 HE ARG A 721 -1.360 -14.173 -58.876 1.00 0.00 H ATOM 68 HH12 ARG A 721 -3.497 -16.755 -57.774 1.00 0.00 H ATOM 69 HH11 ARG A 721 -1.796 -16.185 -57.932 1.00 0.00 H ATOM 70 HH22 ARG A 721 -5.222 -15.451 -58.511 1.00 0.00 H ATOM 71 HH21 ARG A 721 -4.889 -13.845 -59.255 1.00 0.00 H ATOM 72 H ARG A 721 -0.378 -8.375 -62.018 1.00 0.00 H ATOM 73 N ILE A 722 0.464 -9.016 -58.490 1.00 35.57 N ATOM 74 CA ILE A 722 1.771 -9.233 -57.879 1.00 31.30 C ATOM 75 C ILE A 722 1.824 -10.649 -57.325 1.00 32.07 C ATOM 76 O ILE A 722 0.911 -11.087 -56.615 1.00 38.63 O ATOM 77 CB ILE A 722 2.038 -8.192 -56.777 1.00 32.21 C ATOM 78 CG1 ILE A 722 2.125 -6.788 -57.380 1.00 35.27 C ATOM 79 CG2 ILE A 722 3.337 -8.500 -56.025 1.00 33.88 C ATOM 80 CD1 ILE A 722 1.979 -5.668 -56.366 1.00 43.64 C ATOM 81 H ILE A 722 -0.274 -8.528 -57.943 1.00 0.00 H ATOM 82 N GLU A 723 2.893 -11.370 -57.656 1.00 30.31 N ATOM 83 CA GLU A 723 3.142 -12.705 -57.129 1.00 33.97 C ATOM 84 C GLU A 723 4.155 -12.709 -55.992 1.00 37.64 C ATOM 85 O GLU A 723 4.017 -13.499 -55.054 1.00 35.42 O ATOM 86 CB GLU A 723 3.647 -13.625 -58.250 1.00 38.80 C ATOM 87 CG GLU A 723 2.760 -13.671 -59.502 1.00 41.80 C ATOM 88 CD GLU A 723 1.387 -14.263 -59.237 1.00 49.34 C ATOM 89 OE1 GLU A 723 0.487 -14.082 -60.087 1.00 46.01 O ATOM 90 OE2 GLU A 723 1.208 -14.909 -58.184 1.00 53.83 O ATOM 91 H GLU A 723 3.581 -10.962 -58.321 1.00 0.00 H ATOM 92 N GLU A 724 5.163 -11.841 -56.061 1.00 38.91 N ATOM 93 CA GLU A 724 6.224 -11.765 -55.068 1.00 34.51 C ATOM 94 C GLU A 724 6.712 -10.327 -55.018 1.00 37.31 C ATOM 95 O GLU A 724 6.543 -9.565 -55.972 1.00 34.59 O ATOM 96 CB GLU A 724 7.378 -12.715 -55.395 1.00 40.89 C ATOM 97 CG GLU A 724 6.989 -14.175 -55.353 1.00 53.37 C ATOM 98 CD GLU A 724 8.180 -15.098 -55.499 1.00 57.68 C ATOM 99 OE1 GLU A 724 9.100 -14.767 -56.278 1.00 45.58 O ATOM 100 OE2 GLU A 724 8.201 -16.153 -54.829 1.00 70.04 O ATOM 101 H GLU A 724 5.193 -11.184 -56.866 1.00 0.00 H ATOM 102 N GLU A 725 7.325 -9.961 -53.894 1.00 37.17 N ATOM 103 CA GLU A 725 7.623 -8.559 -53.637 1.00 31.23 C ATOM 104 C GLU A 725 8.641 -8.455 -52.514 1.00 32.75 C ATOM 105 O GLU A 725 8.452 -9.045 -51.446 1.00 31.13 O ATOM 106 CB GLU A 725 6.347 -7.805 -53.262 1.00 31.66 C ATOM 107 CG GLU A 725 6.372 -6.327 -53.542 1.00 35.32 C ATOM 108 CD GLU A 725 5.006 -5.708 -53.355 1.00 38.31 C ATOM 109 OE1 GLU A 725 4.175 -6.323 -52.657 1.00 35.02 O ATOM 110 OE2 GLU A 725 4.755 -4.617 -53.909 1.00 50.20 O ATOM 111 H GLU A 725 7.593 -10.682 -53.194 1.00 0.00 H ATOM 112 N GLU A 726 9.716 -7.719 -52.765 1.00 32.01 N ATOM 113 CA GLU A 726 10.637 -7.287 -51.727 1.00 31.58 C ATOM 114 C GLU A 726 10.378 -5.811 -51.466 1.00 30.35 C ATOM 115 O GLU A 726 10.332 -5.014 -52.408 1.00 30.64 O ATOM 116 CB GLU A 726 12.092 -7.520 -52.138 1.00 33.63 C ATOM 117 CG GLU A 726 13.081 -7.313 -51.001 1.00 37.12 C ATOM 118 CD GLU A 726 14.523 -7.262 -51.466 1.00 47.09 C ATOM 119 OE1 GLU A 726 14.841 -6.422 -52.338 1.00 58.70 O ATOM 120 OE2 GLU A 726 15.339 -8.062 -50.961 1.00 40.32 O ATOM 121 H GLU A 726 9.908 -7.439 -53.748 1.00 0.00 H ATOM 122 N LEU A 727 10.173 -5.454 -50.200 1.00 28.04 N ATOM 123 CA LEU A 727 9.858 -4.083 -49.833 1.00 30.32 C ATOM 124 C LEU A 727 10.821 -3.592 -48.762 1.00 31.63 C ATOM 125 O LEU A 727 11.447 -4.376 -48.044 1.00 28.59 O ATOM 126 CB LEU A 727 8.426 -3.933 -49.300 1.00 30.59 C ATOM 127 CG LEU A 727 7.253 -4.531 -50.067 1.00 35.06 C ATOM 128 CD1 LEU A 727 7.075 -5.992 -49.728 1.00 43.02 C ATOM 129 CD2 LEU A 727 6.000 -3.757 -49.721 1.00 45.16 C ATOM 130 H LEU A 727 10.240 -6.175 -49.454 1.00 0.00 H ATOM 131 N THR A 728 10.917 -2.271 -48.662 1.00 30.65 N ATOM 132 CA THR A 728 11.587 -1.599 -47.558 1.00 31.65 C ATOM 133 C THR A 728 10.538 -0.741 -46.870 1.00 30.10 C ATOM 134 O THR A 728 9.944 0.142 -47.499 1.00 28.98 O ATOM 135 CB THR A 728 12.772 -0.758 -48.047 1.00 35.69 C ATOM 136 OG1 THR A 728 13.790 -1.624 -48.562 1.00 35.36 O ATOM 137 CG2 THR A 728 13.365 0.085 -46.914 1.00 36.04 C ATOM 138 HG1 THR A 728 14.555 -1.081 -48.878 1.00 0.00 H ATOM 139 H THR A 728 10.492 -1.687 -49.410 1.00 0.00 H ATOM 140 N LEU A 729 10.284 -1.028 -45.598 1.00 30.29 N ATOM 141 CA LEU A 729 9.268 -0.337 -44.823 1.00 29.14 C ATOM 142 C LEU A 729 9.916 0.304 -43.605 1.00 26.94 C ATOM 143 O LEU A 729 10.913 -0.195 -43.077 1.00 27.42 O ATOM 144 CB LEU A 729 8.163 -1.298 -44.376 1.00 29.27 C ATOM 145 CG LEU A 729 7.634 -2.251 -45.452 1.00 33.63 C ATOM 146 CD1 LEU A 729 6.634 -3.222 -44.854 1.00 33.15 C ATOM 147 CD2 LEU A 729 7.006 -1.489 -46.602 1.00 32.44 C ATOM 148 H LEU A 729 10.836 -1.779 -45.137 1.00 0.00 H ATOM 149 N THR A 730 9.331 1.406 -43.148 1.00 26.48 N ATOM 150 CA THR A 730 9.882 2.174 -42.038 1.00 31.54 C ATOM 151 C THR A 730 8.781 2.343 -41.000 1.00 29.59 C ATOM 152 O THR A 730 7.776 3.014 -41.261 1.00 24.77 O ATOM 153 CB THR A 730 10.422 3.527 -42.516 1.00 32.72 C ATOM 154 OG1 THR A 730 11.232 3.338 -43.682 1.00 36.88 O ATOM 155 CG2 THR A 730 11.278 4.169 -41.447 1.00 34.82 C ATOM 156 HG1 THR A 730 11.578 4.214 -43.987 1.00 0.00 H ATOM 157 H THR A 730 8.451 1.731 -43.597 1.00 0.00 H ATOM 158 N ILE A 731 8.961 1.716 -39.828 1.00 26.68 N ATOM 159 CA ILE A 731 8.009 1.827 -38.727 1.00 26.93 C ATOM 160 C ILE A 731 8.469 2.920 -37.776 1.00 26.44 C ATOM 161 O ILE A 731 9.650 2.993 -37.415 1.00 25.13 O ATOM 162 CB ILE A 731 7.865 0.494 -37.973 1.00 27.55 C ATOM 163 CG1 ILE A 731 7.611 -0.654 -38.949 1.00 29.37 C ATOM 164 CG2 ILE A 731 6.747 0.609 -36.936 1.00 26.10 C ATOM 165 CD1 ILE A 731 7.525 -2.024 -38.288 1.00 32.67 C ATOM 166 H ILE A 731 9.810 1.129 -39.699 1.00 0.00 H ATOM 167 N LEU A 732 7.530 3.755 -37.341 1.00 28.09 N ATOM 168 CA LEU A 732 7.798 4.776 -36.334 1.00 33.41 C ATOM 169 C LEU A 732 7.263 4.269 -34.997 1.00 34.54 C ATOM 170 O LEU A 732 6.047 4.166 -34.802 1.00 35.06 O ATOM 171 CB LEU A 732 7.169 6.113 -36.724 1.00 40.11 C ATOM 172 CG LEU A 732 7.419 7.275 -35.754 1.00 49.54 C ATOM 173 CD1 LEU A 732 8.906 7.488 -35.501 1.00 53.11 C ATOM 174 CD2 LEU A 732 6.788 8.563 -36.265 1.00 49.85 C ATOM 175 H LEU A 732 6.570 3.677 -37.733 1.00 0.00 H ATOM 176 N ARG A 733 8.176 3.948 -34.081 1.00 33.81 N ATOM 177 CA ARG A 733 7.789 3.366 -32.802 1.00 36.69 C ATOM 178 C ARG A 733 6.933 4.333 -31.990 1.00 39.19 C ATOM 179 O ARG A 733 7.126 5.552 -32.019 1.00 41.61 O ATOM 180 CB ARG A 733 9.029 2.975 -31.993 1.00 31.92 C ATOM 181 CG ARG A 733 8.700 2.488 -30.583 1.00 36.38 C ATOM 182 CD ARG A 733 9.934 2.063 -29.792 1.00 30.40 C ATOM 183 NE ARG A 733 10.950 1.388 -30.598 1.00 26.84 N ATOM 184 CZ ARG A 733 11.138 0.070 -30.646 1.00 26.76 C ATOM 185 NH1 ARG A 733 10.377 -0.750 -29.937 1.00 29.01 N ATOM 186 NH2 ARG A 733 12.099 -0.433 -31.408 1.00 27.16 N ATOM 187 HE ARG A 733 11.574 1.983 -31.179 1.00 0.00 H ATOM 188 HH12 ARG A 733 10.535 -1.777 -29.984 1.00 0.00 H ATOM 189 HH11 ARG A 733 9.622 -0.367 -29.333 1.00 0.00 H ATOM 190 HH22 ARG A 733 12.247 -1.462 -31.447 1.00 0.00 H ATOM 191 HH21 ARG A 733 12.705 0.201 -31.967 1.00 0.00 H ATOM 192 H ARG A 733 9.182 4.116 -34.282 1.00 0.00 H ATOM 193 N GLN A 734 5.980 3.768 -31.256 1.00 41.07 N ATOM 194 CA GLN A 734 5.175 4.492 -30.285 1.00 44.74 C ATOM 195 C GLN A 734 5.366 3.853 -28.916 1.00 45.96 C ATOM 196 O GLN A 734 6.025 2.819 -28.772 1.00 41.20 O ATOM 197 CB GLN A 734 3.690 4.490 -30.670 1.00 47.96 C ATOM 198 CG GLN A 734 3.425 4.653 -32.160 1.00 49.95 C ATOM 199 CD GLN A 734 3.734 6.040 -32.682 1.00 71.78 C ATOM 200 OE1 GLN A 734 3.934 6.979 -31.913 1.00 80.53 O ATOM 201 NE2 GLN A 734 3.768 6.174 -34.004 1.00 76.23 N ATOM 202 HE22 GLN A 734 3.592 5.351 -34.615 1.00 0.00 H ATOM 203 HE21 GLN A 734 3.970 7.102 -34.428 1.00 0.00 H ATOM 204 H GLN A 734 5.800 2.752 -31.383 1.00 0.00 H ATOM 205 N THR A 735 4.769 4.475 -27.898 1.00 49.04 N ATOM 206 CA THR A 735 4.988 4.020 -26.529 1.00 52.07 C ATOM 207 C THR A 735 4.618 2.554 -26.356 1.00 47.45 C ATOM 208 O THR A 735 5.272 1.835 -25.591 1.00 46.89 O ATOM 209 CB THR A 735 4.194 4.888 -25.554 1.00 61.16 C ATOM 210 OG1 THR A 735 2.860 5.071 -26.048 1.00 58.71 O ATOM 211 CG2 THR A 735 4.873 6.241 -25.377 1.00 54.45 C ATOM 212 HG1 THR A 735 2.349 5.634 -25.414 1.00 0.00 H ATOM 213 H THR A 735 4.145 5.287 -28.081 1.00 0.00 H ATOM 214 N GLY A 736 3.584 2.090 -27.050 1.00 43.42 N ATOM 215 CA GLY A 736 3.196 0.698 -26.965 1.00 47.40 C ATOM 216 C GLY A 736 4.078 -0.270 -27.722 1.00 48.67 C ATOM 217 O GLY A 736 3.889 -1.484 -27.598 1.00 50.36 O ATOM 218 H GLY A 736 3.046 2.736 -27.663 1.00 0.00 H ATOM 219 N GLY A 737 5.040 0.230 -28.500 1.00 39.24 N ATOM 220 CA GLY A 737 5.919 -0.620 -29.282 1.00 31.51 C ATOM 221 C GLY A 737 5.727 -0.477 -30.780 1.00 32.03 C ATOM 222 O GLY A 737 5.297 0.575 -31.262 1.00 32.93 O ATOM 223 H GLY A 737 5.164 1.262 -28.548 1.00 0.00 H ATOM 224 N LEU A 738 6.041 -1.535 -31.530 1.00 31.57 N ATOM 225 CA LEU A 738 5.986 -1.506 -32.986 1.00 27.79 C ATOM 226 C LEU A 738 4.682 -2.047 -33.560 1.00 29.06 C ATOM 227 O LEU A 738 4.458 -1.911 -34.767 1.00 32.27 O ATOM 228 CB LEU A 738 7.153 -2.308 -33.569 1.00 27.55 C ATOM 229 CG LEU A 738 8.540 -1.913 -33.061 1.00 31.81 C ATOM 230 CD1 LEU A 738 9.593 -2.872 -33.609 1.00 28.06 C ATOM 231 CD2 LEU A 738 8.862 -0.473 -33.442 1.00 28.77 C ATOM 232 H LEU A 738 6.336 -2.413 -31.058 1.00 0.00 H ATOM 233 N GLY A 739 3.829 -2.657 -32.743 1.00 24.77 N ATOM 234 CA GLY A 739 2.586 -3.212 -33.248 1.00 26.07 C ATOM 235 C GLY A 739 2.762 -4.436 -34.121 1.00 29.46 C ATOM 236 O GLY A 739 2.002 -4.623 -35.076 1.00 28.86 O ATOM 237 H GLY A 739 4.055 -2.738 -31.731 1.00 0.00 H ATOM 238 N ILE A 740 3.757 -5.275 -33.826 1.00 25.85 N ATOM 239 CA ILE A 740 3.978 -6.515 -34.556 1.00 23.82 C ATOM 240 C ILE A 740 4.321 -7.632 -33.581 1.00 23.84 C ATOM 241 O ILE A 740 4.808 -7.401 -32.473 1.00 20.70 O ATOM 242 CB ILE A 740 5.111 -6.388 -35.593 1.00 28.27 C ATOM 243 CG1 ILE A 740 6.438 -6.078 -34.887 1.00 27.83 C ATOM 244 CG2 ILE A 740 4.775 -5.321 -36.606 1.00 32.31 C ATOM 245 CD1 ILE A 740 7.635 -6.194 -35.775 1.00 34.20 C ATOM 246 H ILE A 740 4.399 -5.034 -33.044 1.00 0.00 H ATOM 247 N SER A 741 4.095 -8.859 -34.033 1.00 23.66 N ATOM 248 CA SER A 741 4.679 -10.038 -33.418 1.00 22.83 C ATOM 249 C SER A 741 5.489 -10.773 -34.471 1.00 22.19 C ATOM 250 O SER A 741 5.143 -10.763 -35.657 1.00 25.36 O ATOM 251 CB SER A 741 3.616 -10.972 -32.835 1.00 24.84 C ATOM 252 OG SER A 741 2.761 -10.268 -31.954 1.00 29.11 O ATOM 253 HG SER A 741 3.295 -9.887 -31.212 1.00 0.00 H ATOM 254 H SER A 741 3.476 -8.981 -34.860 1.00 0.00 H ATOM 255 N ILE A 742 6.578 -11.397 -34.039 1.00 20.75 N ATOM 256 CA ILE A 742 7.433 -12.131 -34.957 1.00 22.22 C ATOM 257 C ILE A 742 7.495 -13.581 -34.502 1.00 21.63 C ATOM 258 O ILE A 742 7.362 -13.890 -33.312 1.00 23.46 O ATOM 259 CB ILE A 742 8.846 -11.504 -35.074 1.00 20.78 C ATOM 260 CG1 ILE A 742 9.585 -11.507 -33.735 1.00 20.61 C ATOM 261 CG2 ILE A 742 8.744 -10.064 -35.625 1.00 22.03 C ATOM 262 CD1 ILE A 742 11.065 -11.285 -33.874 1.00 21.59 C ATOM 263 H ILE A 742 6.823 -11.360 -33.029 1.00 0.00 H ATOM 264 N ALA A 743 7.676 -14.475 -35.470 1.00 20.41 N ATOM 265 CA ALA A 743 7.753 -15.902 -35.211 1.00 21.33 C ATOM 266 C ALA A 743 8.914 -16.499 -35.992 1.00 23.26 C ATOM 267 O ALA A 743 9.434 -15.899 -36.937 1.00 23.06 O ATOM 268 CB ALA A 743 6.431 -16.612 -35.579 1.00 23.94 C ATOM 269 H ALA A 743 7.766 -14.139 -36.450 1.00 0.00 H ATOM 270 N GLY A 744 9.323 -17.693 -35.576 1.00 22.06 N ATOM 271 CA GLY A 744 10.336 -18.440 -36.293 1.00 22.41 C ATOM 272 C GLY A 744 11.737 -18.179 -35.778 1.00 27.01 C ATOM 273 O GLY A 744 11.960 -17.510 -34.763 1.00 27.54 O ATOM 274 H GLY A 744 8.906 -18.101 -34.715 1.00 0.00 H ATOM 275 N GLY A 745 12.702 -18.747 -36.497 1.00 26.71 N ATOM 276 CA GLY A 745 14.112 -18.550 -36.198 1.00 28.66 C ATOM 277 C GLY A 745 14.866 -19.862 -36.100 1.00 30.67 C ATOM 278 O GLY A 745 14.297 -20.917 -35.808 1.00 28.58 O ATOM 279 H GLY A 745 12.439 -19.353 -37.300 1.00 0.00 H ATOM 280 N LYS A 746 16.173 -19.796 -36.350 1.00 32.08 N ATOM 281 CA LYS A 746 17.019 -20.979 -36.265 1.00 32.88 C ATOM 282 C LYS A 746 16.929 -21.595 -34.876 1.00 32.56 C ATOM 283 O LYS A 746 17.021 -20.892 -33.865 1.00 32.75 O ATOM 284 CB LYS A 746 18.469 -20.609 -36.582 1.00 38.19 C ATOM 285 CG LYS A 746 19.364 -21.808 -36.832 1.00 45.54 C ATOM 286 CD LYS A 746 20.716 -21.400 -37.401 1.00 56.00 C ATOM 287 CE LYS A 746 21.564 -20.654 -36.384 1.00 65.20 C ATOM 288 NZ LYS A 746 21.867 -21.483 -35.182 1.00 71.20 N ATOM 289 HZ1 LYS A 746 20.977 -21.759 -34.720 1.00 0.00 H ATOM 290 HZ2 LYS A 746 22.387 -22.335 -35.472 1.00 0.00 H ATOM 291 HZ3 LYS A 746 22.447 -20.931 -34.519 1.00 0.00 H ATOM 292 H LYS A 746 16.597 -18.883 -36.611 1.00 0.00 H ATOM 293 N GLY A 747 16.757 -22.917 -34.826 1.00 35.07 N ATOM 294 CA GLY A 747 16.702 -23.642 -33.576 1.00 36.11 C ATOM 295 C GLY A 747 15.308 -23.863 -33.019 1.00 35.48 C ATOM 296 O GLY A 747 15.123 -24.765 -32.193 1.00 37.84 O ATOM 297 H GLY A 747 16.659 -23.444 -35.717 1.00 0.00 H ATOM 298 N SER A 748 14.325 -23.066 -33.440 1.00 32.66 N ATOM 299 CA SER A 748 12.941 -23.191 -32.997 1.00 30.36 C ATOM 300 C SER A 748 12.080 -23.720 -34.143 1.00 28.36 C ATOM 301 O SER A 748 12.562 -23.974 -35.252 1.00 30.23 O ATOM 302 CB SER A 748 12.413 -21.848 -32.475 1.00 25.39 C ATOM 303 OG SER A 748 12.448 -20.837 -33.469 1.00 31.18 O ATOM 304 HG SER A 748 11.887 -21.111 -34.237 1.00 0.00 H ATOM 305 H SER A 748 14.558 -22.315 -34.121 1.00 0.00 H ATOM 306 N THR A 749 10.786 -23.884 -33.865 1.00 26.77 N ATOM 307 CA THR A 749 9.870 -24.491 -34.830 1.00 30.33 C ATOM 308 C THR A 749 9.583 -23.513 -35.968 1.00 27.33 C ATOM 309 O THR A 749 9.253 -22.350 -35.709 1.00 27.25 O ATOM 310 CB THR A 749 8.569 -24.917 -34.132 1.00 31.33 C ATOM 311 OG1 THR A 749 8.804 -26.107 -33.369 1.00 31.15 O ATOM 312 CG2 THR A 749 7.434 -25.195 -35.123 1.00 28.26 C ATOM 313 HG1 THR A 749 7.965 -26.381 -32.920 1.00 0.00 H ATOM 314 H THR A 749 10.420 -23.574 -32.942 1.00 0.00 H ATOM 315 N PRO A 750 9.717 -23.931 -37.226 1.00 27.13 N ATOM 316 CA PRO A 750 9.447 -23.013 -38.339 1.00 29.80 C ATOM 317 C PRO A 750 8.047 -22.417 -38.279 1.00 30.85 C ATOM 318 O PRO A 750 7.076 -23.085 -37.916 1.00 29.67 O ATOM 319 CB PRO A 750 9.624 -23.899 -39.573 1.00 35.33 C ATOM 320 CG PRO A 750 10.643 -24.912 -39.151 1.00 32.84 C ATOM 321 CD PRO A 750 10.418 -25.150 -37.678 1.00 31.17 C ATOM 322 N TYR A 751 7.955 -21.139 -38.651 1.00 29.61 N ATOM 323 CA TYR A 751 6.655 -20.500 -38.815 1.00 31.04 C ATOM 324 C TYR A 751 5.895 -21.072 -39.998 1.00 32.87 C ATOM 325 O TYR A 751 4.658 -21.085 -39.997 1.00 34.26 O ATOM 326 CB TYR A 751 6.836 -18.997 -39.013 1.00 26.29 C ATOM 327 CG TYR A 751 5.560 -18.261 -39.342 1.00 30.44 C ATOM 328 CD1 TYR A 751 4.612 -17.998 -38.362 1.00 30.12 C ATOM 329 CD2 TYR A 751 5.309 -17.814 -40.631 1.00 31.72 C ATOM 330 CE1 TYR A 751 3.452 -17.318 -38.659 1.00 25.92 C ATOM 331 CE2 TYR A 751 4.153 -17.133 -40.935 1.00 27.65 C ATOM 332 CZ TYR A 751 3.227 -16.886 -39.951 1.00 27.48 C ATOM 333 OH TYR A 751 2.071 -16.202 -40.270 1.00 26.92 O ATOM 334 HH TYR A 751 1.570 -16.706 -40.959 1.00 0.00 H ATOM 335 H TYR A 751 8.822 -20.592 -38.826 1.00 0.00 H ATOM 336 N LYS A 752 6.611 -21.544 -41.012 1.00 38.18 N ATOM 337 CA LYS A 752 6.007 -21.825 -42.310 1.00 46.34 C ATOM 338 C LYS A 752 6.840 -22.902 -42.983 1.00 47.62 C ATOM 339 O LYS A 752 8.004 -22.665 -43.320 1.00 46.64 O ATOM 340 CB LYS A 752 5.952 -20.555 -43.155 1.00 52.33 C ATOM 341 CG LYS A 752 5.351 -20.710 -44.538 1.00 57.96 C ATOM 342 CD LYS A 752 5.855 -19.601 -45.449 1.00 63.31 C ATOM 343 CE LYS A 752 4.894 -19.317 -46.584 1.00 70.16 C ATOM 344 NZ LYS A 752 5.379 -18.201 -47.443 1.00 65.23 N ATOM 345 HZ1 LYS A 752 5.475 -17.339 -46.868 1.00 0.00 H ATOM 346 HZ2 LYS A 752 6.303 -18.453 -47.848 1.00 0.00 H ATOM 347 HZ3 LYS A 752 4.697 -18.034 -48.210 1.00 0.00 H ATOM 348 H LYS A 752 7.628 -21.718 -40.877 1.00 0.00 H ATOM 349 N GLY A 753 6.249 -24.075 -43.171 1.00 47.84 N ATOM 350 CA GLY A 753 6.969 -25.158 -43.816 1.00 45.92 C ATOM 351 C GLY A 753 8.269 -25.431 -43.089 1.00 47.02 C ATOM 352 O GLY A 753 8.312 -25.523 -41.857 1.00 44.40 O ATOM 353 H GLY A 753 5.268 -24.219 -42.856 1.00 0.00 H ATOM 354 N ASP A 754 9.350 -25.561 -43.857 1.00 40.84 N ATOM 355 CA ASP A 754 10.675 -25.793 -43.300 1.00 50.12 C ATOM 356 C ASP A 754 11.537 -24.535 -43.302 1.00 46.40 C ATOM 357 O ASP A 754 12.746 -24.621 -43.063 1.00 44.59 O ATOM 358 CB ASP A 754 11.380 -26.907 -44.075 1.00 57.54 C ATOM 359 CG ASP A 754 12.365 -27.680 -43.217 1.00 84.09 C ATOM 360 OD1 ASP A 754 12.758 -27.165 -42.147 1.00 95.66 O ATOM 361 OD2 ASP A 754 12.745 -28.802 -43.613 1.00 91.74 O ATOM 362 H ASP A 754 9.244 -25.494 -44.889 1.00 0.00 H ATOM 363 N ASP A 755 10.944 -23.375 -43.568 1.00 41.24 N ATOM 364 CA ASP A 755 11.680 -22.119 -43.574 1.00 40.69 C ATOM 365 C ASP A 755 11.919 -21.666 -42.139 1.00 36.83 C ATOM 366 O ASP A 755 10.966 -21.439 -41.385 1.00 31.76 O ATOM 367 CB ASP A 755 10.904 -21.063 -44.354 1.00 38.99 C ATOM 368 CG ASP A 755 11.736 -19.838 -44.659 1.00 33.90 C ATOM 369 OD1 ASP A 755 12.765 -19.623 -43.983 1.00 33.34 O ATOM 370 OD2 ASP A 755 11.356 -19.084 -45.578 1.00 39.60 O ATOM 371 H ASP A 755 9.925 -23.365 -43.778 1.00 0.00 H ATOM 372 N GLU A 756 13.187 -21.530 -41.762 1.00 36.55 N ATOM 373 CA GLU A 756 13.553 -21.140 -40.408 1.00 36.09 C ATOM 374 C GLU A 756 13.727 -19.634 -40.251 1.00 27.75 C ATOM 375 O GLU A 756 14.201 -19.183 -39.203 1.00 27.75 O ATOM 376 CB GLU A 756 14.835 -21.863 -39.988 1.00 34.68 C ATOM 377 CG GLU A 756 14.658 -23.364 -39.820 1.00 46.43 C ATOM 378 CD GLU A 756 15.703 -23.970 -38.905 1.00 53.87 C ATOM 379 OE1 GLU A 756 16.896 -23.638 -39.064 1.00 53.89 O ATOM 380 OE2 GLU A 756 15.326 -24.768 -38.019 1.00 62.81 O ATOM 381 H GLU A 756 13.941 -21.708 -42.456 1.00 0.00 H ATOM 382 N GLY A 757 13.348 -18.850 -41.254 1.00 28.17 N ATOM 383 CA GLY A 757 13.498 -17.413 -41.184 1.00 26.62 C ATOM 384 C GLY A 757 12.546 -16.789 -40.179 1.00 28.48 C ATOM 385 O GLY A 757 11.748 -17.452 -39.516 1.00 29.39 O ATOM 386 H GLY A 757 12.935 -19.278 -42.107 1.00 0.00 H ATOM 387 N ILE A 758 12.645 -15.468 -40.068 1.00 26.60 N ATOM 388 CA ILE A 758 11.827 -14.689 -39.145 1.00 25.07 C ATOM 389 C ILE A 758 10.642 -14.130 -39.910 1.00 24.93 C ATOM 390 O ILE A 758 10.807 -13.560 -40.995 1.00 24.11 O ATOM 391 CB ILE A 758 12.645 -13.562 -38.495 1.00 26.03 C ATOM 392 CG1 ILE A 758 13.764 -14.169 -37.659 1.00 26.74 C ATOM 393 CG2 ILE A 758 11.768 -12.685 -37.603 1.00 24.10 C ATOM 394 CD1 ILE A 758 15.061 -13.506 -37.860 1.00 31.40 C ATOM 395 H ILE A 758 13.335 -14.969 -40.665 1.00 0.00 H ATOM 396 N PHE A 759 9.448 -14.279 -39.339 1.00 26.08 N ATOM 397 CA PHE A 759 8.214 -13.913 -40.012 1.00 20.45 C ATOM 398 C PHE A 759 7.369 -13.012 -39.124 1.00 20.43 C ATOM 399 O PHE A 759 7.407 -13.106 -37.895 1.00 19.14 O ATOM 400 CB PHE A 759 7.418 -15.161 -40.397 1.00 22.06 C ATOM 401 CG PHE A 759 8.025 -15.942 -41.530 1.00 23.78 C ATOM 402 CD1 PHE A 759 8.898 -16.990 -41.281 1.00 24.94 C ATOM 403 CD2 PHE A 759 7.727 -15.625 -42.847 1.00 23.70 C ATOM 404 CE1 PHE A 759 9.458 -17.710 -42.323 1.00 27.76 C ATOM 405 CE2 PHE A 759 8.284 -16.344 -43.894 1.00 24.77 C ATOM 406 CZ PHE A 759 9.151 -17.387 -43.630 1.00 26.11 C ATOM 407 H PHE A 759 9.397 -14.671 -38.377 1.00 0.00 H ATOM 408 N ILE A 760 6.619 -12.119 -39.766 1.00 22.34 N ATOM 409 CA ILE A 760 5.589 -11.355 -39.071 1.00 24.20 C ATOM 410 C ILE A 760 4.394 -12.272 -38.843 1.00 25.31 C ATOM 411 O ILE A 760 3.787 -12.774 -39.797 1.00 25.84 O ATOM 412 CB ILE A 760 5.178 -10.114 -39.878 1.00 23.13 C ATOM 413 CG1 ILE A 760 6.375 -9.190 -40.152 1.00 22.57 C ATOM 414 CG2 ILE A 760 4.059 -9.362 -39.163 1.00 27.29 C ATOM 415 CD1 ILE A 760 6.874 -8.409 -38.948 1.00 22.71 C ATOM 416 H ILE A 760 6.770 -11.963 -40.783 1.00 0.00 H ATOM 417 N SER A 761 4.050 -12.494 -37.577 1.00 26.11 N ATOM 418 CA SER A 761 2.914 -13.334 -37.221 1.00 23.66 C ATOM 419 C SER A 761 1.664 -12.537 -36.880 1.00 20.85 C ATOM 420 O SER A 761 0.578 -13.121 -36.815 1.00 26.84 O ATOM 421 CB SER A 761 3.275 -14.233 -36.033 1.00 22.65 C ATOM 422 OG SER A 761 3.621 -13.453 -34.904 1.00 23.44 O ATOM 423 HG SER A 761 3.850 -14.051 -34.149 1.00 0.00 H ATOM 424 H SER A 761 4.609 -12.054 -36.818 1.00 0.00 H ATOM 425 N ARG A 762 1.785 -11.230 -36.663 1.00 24.35 N ATOM 426 CA ARG A 762 0.657 -10.432 -36.212 1.00 27.55 C ATOM 427 C ARG A 762 0.942 -8.963 -36.494 1.00 26.67 C ATOM 428 O ARG A 762 2.090 -8.524 -36.391 1.00 24.66 O ATOM 429 CB ARG A 762 0.422 -10.671 -34.719 1.00 24.48 C ATOM 430 CG ARG A 762 -0.854 -10.098 -34.151 1.00 34.49 C ATOM 431 CD ARG A 762 -1.069 -10.630 -32.729 1.00 35.54 C ATOM 432 NE ARG A 762 -2.042 -9.855 -31.961 1.00 41.86 N ATOM 433 CZ ARG A 762 -2.226 -9.976 -30.649 1.00 46.56 C ATOM 434 NH1 ARG A 762 -1.499 -10.838 -29.946 1.00 45.79 N ATOM 435 NH2 ARG A 762 -3.130 -9.230 -30.030 1.00 50.01 N ATOM 436 HE ARG A 762 -2.628 -9.165 -32.473 1.00 0.00 H ATOM 437 HH12 ARG A 762 -1.647 -10.928 -28.921 1.00 0.00 H ATOM 438 HH11 ARG A 762 -0.782 -11.422 -30.421 1.00 0.00 H ATOM 439 HH22 ARG A 762 -3.271 -9.328 -29.004 1.00 0.00 H ATOM 440 HH21 ARG A 762 -3.699 -8.547 -30.570 1.00 0.00 H ATOM 441 H ARG A 762 2.705 -10.770 -36.819 1.00 0.00 H ATOM 442 N VAL A 763 -0.099 -8.212 -36.853 1.00 24.74 N ATOM 443 CA VAL A 763 0.000 -6.766 -37.030 1.00 30.05 C ATOM 444 C VAL A 763 -1.174 -6.126 -36.303 1.00 34.24 C ATOM 445 O VAL A 763 -2.334 -6.454 -36.580 1.00 34.31 O ATOM 446 CB VAL A 763 0.002 -6.342 -38.511 1.00 28.52 C ATOM 447 CG1 VAL A 763 0.276 -4.845 -38.620 1.00 28.82 C ATOM 448 CG2 VAL A 763 1.030 -7.146 -39.318 1.00 26.42 C ATOM 449 H VAL A 763 -1.017 -8.674 -37.013 1.00 0.00 H ATOM 450 N SER A 764 -0.877 -5.214 -35.383 1.00 33.54 N ATOM 451 CA SER A 764 -1.929 -4.502 -34.672 1.00 35.08 C ATOM 452 C SER A 764 -2.713 -3.635 -35.645 1.00 40.26 C ATOM 453 O SER A 764 -2.130 -2.872 -36.420 1.00 39.64 O ATOM 454 CB SER A 764 -1.331 -3.653 -33.556 1.00 35.15 C ATOM 455 OG SER A 764 -0.514 -4.457 -32.722 1.00 37.73 O ATOM 456 HG SER A 764 0.217 -4.852 -33.260 1.00 0.00 H ATOM 457 H SER A 764 0.119 -5.006 -35.168 1.00 0.00 H ATOM 458 N GLU A 765 -4.042 -3.741 -35.581 1.00 47.57 N ATOM 459 CA GLU A 765 -4.895 -3.254 -36.659 1.00 51.79 C ATOM 460 C GLU A 765 -4.567 -1.815 -37.035 1.00 55.86 C ATOM 461 O GLU A 765 -4.343 -1.504 -38.209 1.00 63.87 O ATOM 462 CB GLU A 765 -6.363 -3.386 -36.255 1.00 56.81 C ATOM 463 CG GLU A 765 -7.336 -2.792 -37.255 1.00 64.07 C ATOM 464 CD GLU A 765 -8.760 -3.246 -37.016 1.00 63.84 C ATOM 465 OE1 GLU A 765 -8.959 -4.224 -36.271 1.00 68.08 O ATOM 466 OE2 GLU A 765 -9.678 -2.619 -37.579 1.00 73.01 O ATOM 467 H GLU A 765 -4.478 -4.180 -34.745 1.00 0.00 H ATOM 468 N GLU A 766 -4.541 -0.919 -36.050 1.00 50.25 N ATOM 469 CA GLU A 766 -4.259 0.494 -36.283 1.00 56.11 C ATOM 470 C GLU A 766 -2.907 0.910 -35.707 1.00 51.78 C ATOM 471 O GLU A 766 -2.728 2.058 -35.295 1.00 49.26 O ATOM 472 CB GLU A 766 -5.377 1.355 -35.697 1.00 58.79 C ATOM 473 CG GLU A 766 -6.711 1.185 -36.410 1.00 56.49 C ATOM 474 CD GLU A 766 -7.851 1.899 -35.708 1.00 64.21 C ATOM 475 OE1 GLU A 766 -7.582 2.672 -34.765 1.00 64.26 O ATOM 476 OE2 GLU A 766 -9.018 1.687 -36.103 1.00 65.87 O ATOM 477 H GLU A 766 -4.729 -1.238 -35.078 1.00 0.00 H ATOM 478 N GLY A 767 -1.947 -0.010 -35.690 1.00 46.55 N ATOM 479 CA GLY A 767 -0.682 0.217 -35.038 1.00 42.37 C ATOM 480 C GLY A 767 0.365 0.800 -35.961 1.00 39.94 C ATOM 481 O GLY A 767 0.132 1.033 -37.151 1.00 42.36 O ATOM 482 H GLY A 767 -2.114 -0.922 -36.162 1.00 0.00 H ATOM 483 N PRO A 768 1.556 1.040 -35.413 1.00 37.34 N ATOM 484 CA PRO A 768 2.615 1.681 -36.209 1.00 37.61 C ATOM 485 C PRO A 768 3.021 0.887 -37.437 1.00 33.78 C ATOM 486 O PRO A 768 3.293 1.476 -38.492 1.00 34.33 O ATOM 487 CB PRO A 768 3.768 1.805 -35.201 1.00 37.58 C ATOM 488 CG PRO A 768 3.093 1.811 -33.876 1.00 36.24 C ATOM 489 CD PRO A 768 1.948 0.875 -34.005 1.00 38.95 C ATOM 490 N ALA A 769 3.081 -0.440 -37.326 1.00 31.63 N ATOM 491 CA ALA A 769 3.494 -1.257 -38.462 1.00 30.78 C ATOM 492 C ALA A 769 2.410 -1.310 -39.530 1.00 34.89 C ATOM 493 O ALA A 769 2.711 -1.291 -40.730 1.00 32.19 O ATOM 494 CB ALA A 769 3.844 -2.665 -37.991 1.00 32.55 C ATOM 495 H ALA A 769 2.832 -0.895 -36.425 1.00 0.00 H ATOM 496 N ALA A 770 1.144 -1.402 -39.115 1.00 36.01 N ATOM 497 CA ALA A 770 0.045 -1.318 -40.071 1.00 36.04 C ATOM 498 C ALA A 770 0.132 -0.030 -40.878 1.00 31.70 C ATOM 499 O ALA A 770 -0.003 -0.038 -42.106 1.00 32.50 O ATOM 500 CB ALA A 770 -1.295 -1.402 -39.339 1.00 31.31 C ATOM 501 H ALA A 770 0.940 -1.534 -38.104 1.00 0.00 H ATOM 502 N ARG A 771 0.357 1.093 -40.197 1.00 37.13 N ATOM 503 CA ARG A 771 0.537 2.359 -40.897 1.00 37.37 C ATOM 504 C ARG A 771 1.667 2.266 -41.915 1.00 33.38 C ATOM 505 O ARG A 771 1.533 2.742 -43.047 1.00 35.49 O ATOM 506 CB ARG A 771 0.809 3.475 -39.886 1.00 42.41 C ATOM 507 CG ARG A 771 -0.438 4.006 -39.190 1.00 46.89 C ATOM 508 CD ARG A 771 -0.076 4.813 -37.949 1.00 55.89 C ATOM 509 NE ARG A 771 -0.750 4.304 -36.756 1.00 74.40 N ATOM 510 CZ ARG A 771 -0.331 4.498 -35.509 1.00 71.51 C ATOM 511 NH1 ARG A 771 0.777 5.187 -35.267 1.00 68.20 N ATOM 512 NH2 ARG A 771 -1.020 3.991 -34.495 1.00 66.92 N ATOM 513 HE ARG A 771 -1.620 3.750 -36.892 1.00 0.00 H ATOM 514 HH12 ARG A 771 1.095 5.333 -34.288 1.00 0.00 H ATOM 515 HH11 ARG A 771 1.327 5.581 -36.057 1.00 0.00 H ATOM 516 HH22 ARG A 771 -0.695 4.141 -33.519 1.00 0.00 H ATOM 517 HH21 ARG A 771 -1.885 3.443 -34.676 1.00 0.00 H ATOM 518 H ARG A 771 0.405 1.066 -39.158 1.00 0.00 H ATOM 519 N ALA A 772 2.780 1.643 -41.541 1.00 32.32 N ATOM 520 CA ALA A 772 3.927 1.553 -42.434 1.00 30.72 C ATOM 521 C ALA A 772 3.775 0.473 -43.502 1.00 30.82 C ATOM 522 O ALA A 772 4.694 0.293 -44.308 1.00 28.21 O ATOM 523 CB ALA A 772 5.204 1.307 -41.622 1.00 32.23 C ATOM 524 H ALA A 772 2.833 1.213 -40.596 1.00 0.00 H ATOM 525 N GLY A 773 2.654 -0.244 -43.533 1.00 30.49 N ATOM 526 CA GLY A 773 2.390 -1.202 -44.590 1.00 29.89 C ATOM 527 C GLY A 773 2.854 -2.621 -44.335 1.00 31.91 C ATOM 528 O GLY A 773 2.862 -3.426 -45.276 1.00 31.17 O ATOM 529 H GLY A 773 1.949 -0.114 -42.780 1.00 0.00 H ATOM 530 N VAL A 774 3.240 -2.961 -43.103 1.00 29.04 N ATOM 531 CA VAL A 774 3.653 -4.327 -42.802 1.00 28.04 C ATOM 532 C VAL A 774 2.431 -5.235 -42.813 1.00 28.53 C ATOM 533 O VAL A 774 1.316 -4.823 -42.462 1.00 24.42 O ATOM 534 CB VAL A 774 4.379 -4.399 -41.446 1.00 29.26 C ATOM 535 CG1 VAL A 774 4.775 -5.840 -41.111 1.00 22.86 C ATOM 536 CG2 VAL A 774 5.605 -3.498 -41.447 1.00 27.80 C ATOM 537 H VAL A 774 3.246 -2.244 -42.350 1.00 0.00 H ATOM 538 N ARG A 775 2.638 -6.489 -43.207 1.00 28.58 N ATOM 539 CA ARG A 775 1.549 -7.445 -43.311 1.00 32.72 C ATOM 540 C ARG A 775 1.944 -8.788 -42.710 1.00 27.93 C ATOM 541 O ARG A 775 3.117 -9.176 -42.714 1.00 20.84 O ATOM 542 CB ARG A 775 1.120 -7.625 -44.775 1.00 33.24 C ATOM 543 CG ARG A 775 0.195 -6.526 -45.256 1.00 37.14 C ATOM 544 CD ARG A 775 0.106 -6.447 -46.772 1.00 44.71 C ATOM 545 NE ARG A 775 -0.537 -7.613 -47.374 1.00 67.39 N ATOM 546 CZ ARG A 775 -1.115 -7.614 -48.574 1.00 80.26 C ATOM 547 NH1 ARG A 775 -1.148 -6.507 -49.307 1.00 76.32 N ATOM 548 NH2 ARG A 775 -1.674 -8.722 -49.040 1.00 84.73 N ATOM 549 HE ARG A 775 -0.544 -8.499 -46.830 1.00 0.00 H ATOM 550 HH12 ARG A 775 -1.601 -6.516 -50.243 1.00 0.00 H ATOM 551 HH11 ARG A 775 -0.721 -5.631 -48.945 1.00 0.00 H ATOM 552 HH22 ARG A 775 -2.125 -8.722 -49.977 1.00 0.00 H ATOM 553 HH21 ARG A 775 -1.661 -9.591 -48.469 1.00 0.00 H ATOM 554 H ARG A 775 3.604 -6.792 -43.446 1.00 0.00 H ATOM 555 N VAL A 776 0.937 -9.490 -42.181 1.00 26.05 N ATOM 556 CA VAL A 776 1.141 -10.846 -41.688 1.00 27.50 C ATOM 557 C VAL A 776 1.730 -11.709 -42.794 1.00 28.30 C ATOM 558 O VAL A 776 1.314 -11.641 -43.959 1.00 28.84 O ATOM 559 CB VAL A 776 -0.185 -11.428 -41.168 1.00 27.61 C ATOM 560 CG1 VAL A 776 -0.058 -12.939 -40.858 1.00 26.20 C ATOM 561 CG2 VAL A 776 -0.641 -10.662 -39.939 1.00 27.12 C ATOM 562 H VAL A 776 -0.008 -9.061 -42.120 1.00 0.00 H ATOM 563 N GLY A 777 2.703 -12.536 -42.425 1.00 26.45 N ATOM 564 CA GLY A 777 3.387 -13.391 -43.366 1.00 28.23 C ATOM 565 C GLY A 777 4.646 -12.800 -43.964 1.00 25.68 C ATOM 566 O GLY A 777 5.443 -13.543 -44.551 1.00 28.64 O ATOM 567 H GLY A 777 2.981 -12.568 -41.423 1.00 0.00 H ATOM 568 N ASP A 778 4.850 -11.491 -43.841 1.00 23.95 N ATOM 569 CA ASP A 778 6.080 -10.883 -44.330 1.00 23.60 C ATOM 570 C ASP A 778 7.292 -11.542 -43.685 1.00 21.65 C ATOM 571 O ASP A 778 7.343 -11.731 -42.467 1.00 23.73 O ATOM 572 CB ASP A 778 6.077 -9.380 -44.045 1.00 21.17 C ATOM 573 CG ASP A 778 5.143 -8.623 -44.960 1.00 25.73 C ATOM 574 OD1 ASP A 778 4.650 -9.234 -45.935 1.00 27.22 O ATOM 575 OD2 ASP A 778 4.907 -7.420 -44.712 1.00 24.03 O ATOM 576 H ASP A 778 4.125 -10.896 -43.392 1.00 0.00 H ATOM 577 N LYS A 779 8.264 -11.900 -44.514 1.00 25.28 N ATOM 578 CA LYS A 779 9.517 -12.470 -44.044 1.00 27.59 C ATOM 579 C LYS A 779 10.523 -11.347 -43.820 1.00 28.86 C ATOM 580 O LYS A 779 10.757 -10.528 -44.716 1.00 28.22 O ATOM 581 CB LYS A 779 10.050 -13.481 -45.057 1.00 24.99 C ATOM 582 CG LYS A 779 11.337 -14.164 -44.652 1.00 23.54 C ATOM 583 CD LYS A 779 11.738 -15.186 -45.699 1.00 25.31 C ATOM 584 CE LYS A 779 12.868 -16.069 -45.221 1.00 29.00 C ATOM 585 NZ LYS A 779 13.004 -17.275 -46.075 1.00 41.28 N ATOM 586 HZ1 LYS A 779 12.120 -17.821 -46.045 1.00 0.00 H ATOM 587 HZ2 LYS A 779 13.200 -16.985 -47.054 1.00 0.00 H ATOM 588 HZ3 LYS A 779 13.787 -17.861 -45.722 1.00 0.00 H ATOM 589 H LYS A 779 8.125 -11.768 -45.536 1.00 0.00 H ATOM 590 N LEU A 780 11.100 -11.305 -42.620 1.00 25.38 N ATOM 591 CA LEU A 780 12.008 -10.234 -42.218 1.00 30.13 C ATOM 592 C LEU A 780 13.431 -10.565 -42.647 1.00 26.32 C ATOM 593 O LEU A 780 14.024 -11.534 -42.158 1.00 30.04 O ATOM 594 CB LEU A 780 11.959 -10.026 -40.707 1.00 32.81 C ATOM 595 CG LEU A 780 11.382 -8.707 -40.205 1.00 34.07 C ATOM 596 CD1 LEU A 780 9.948 -8.546 -40.662 1.00 41.49 C ATOM 597 CD2 LEU A 780 11.473 -8.645 -38.690 1.00 32.25 C ATOM 598 H LEU A 780 10.895 -12.066 -41.942 1.00 0.00 H ATOM 599 N LEU A 781 13.992 -9.736 -43.524 1.00 26.58 N ATOM 600 CA LEU A 781 15.329 -9.962 -44.057 1.00 29.48 C ATOM 601 C LEU A 781 16.403 -9.110 -43.395 1.00 26.02 C ATOM 602 O LEU A 781 17.550 -9.554 -43.295 1.00 22.97 O ATOM 603 CB LEU A 781 15.340 -9.684 -45.563 1.00 30.85 C ATOM 604 CG LEU A 781 14.299 -10.449 -46.383 1.00 30.87 C ATOM 605 CD1 LEU A 781 14.301 -9.986 -47.837 1.00 34.08 C ATOM 606 CD2 LEU A 781 14.550 -11.944 -46.301 1.00 28.50 C ATOM 607 H LEU A 781 13.459 -8.900 -43.839 1.00 0.00 H ATOM 608 N GLU A 782 16.074 -7.900 -42.949 1.00 27.79 N ATOM 609 CA GLU A 782 17.105 -6.992 -42.467 1.00 30.23 C ATOM 610 C GLU A 782 16.457 -5.840 -41.710 1.00 27.24 C ATOM 611 O GLU A 782 15.387 -5.361 -42.100 1.00 22.61 O ATOM 612 CB GLU A 782 17.943 -6.467 -43.641 1.00 36.90 C ATOM 613 CG GLU A 782 19.082 -5.532 -43.264 1.00 40.12 C ATOM 614 CD GLU A 782 19.807 -4.991 -44.483 1.00 48.53 C ATOM 615 OE1 GLU A 782 20.017 -5.761 -45.443 1.00 53.64 O ATOM 616 OE2 GLU A 782 20.160 -3.794 -44.489 1.00 50.72 O ATOM 617 H GLU A 782 15.078 -7.602 -42.945 1.00 0.00 H ATOM 618 N VAL A 783 17.117 -5.397 -40.640 1.00 25.35 N ATOM 619 CA VAL A 783 16.607 -4.338 -39.772 1.00 26.57 C ATOM 620 C VAL A 783 17.732 -3.348 -39.504 1.00 22.99 C ATOM 621 O VAL A 783 18.731 -3.699 -38.864 1.00 18.64 O ATOM 622 CB VAL A 783 16.063 -4.891 -38.443 1.00 26.03 C ATOM 623 CG1 VAL A 783 15.322 -3.800 -37.668 1.00 25.08 C ATOM 624 CG2 VAL A 783 15.166 -6.094 -38.688 1.00 27.71 C ATOM 625 H VAL A 783 18.037 -5.825 -40.413 1.00 0.00 H ATOM 626 N ASN A 784 17.557 -2.113 -39.968 1.00 21.05 N ATOM 627 CA ASN A 784 18.515 -1.031 -39.748 1.00 23.41 C ATOM 628 C ASN A 784 19.953 -1.501 -39.982 1.00 26.01 C ATOM 629 O ASN A 784 20.869 -1.217 -39.206 1.00 26.44 O ATOM 630 CB ASN A 784 18.347 -0.441 -38.347 1.00 21.15 C ATOM 631 CG ASN A 784 17.007 0.255 -38.163 1.00 21.62 C ATOM 632 OD1 ASN A 784 16.315 0.565 -39.134 1.00 19.64 O ATOM 633 ND2 ASN A 784 16.640 0.514 -36.910 1.00 20.46 N ATOM 634 HD22 ASN A 784 17.255 0.234 -36.120 1.00 0.00 H ATOM 635 HD21 ASN A 784 15.738 0.996 -36.721 1.00 0.00 H ATOM 636 H ASN A 784 16.696 -1.908 -40.514 1.00 0.00 H ATOM 637 N GLY A 785 20.146 -2.230 -41.080 1.00 26.63 N ATOM 638 CA GLY A 785 21.458 -2.698 -41.471 1.00 28.59 C ATOM 639 C GLY A 785 21.866 -4.039 -40.903 1.00 30.96 C ATOM 640 O GLY A 785 22.957 -4.523 -41.230 1.00 35.57 O ATOM 641 H GLY A 785 19.328 -2.470 -41.675 1.00 0.00 H ATOM 642 N VAL A 786 21.038 -4.657 -40.068 1.00 24.76 N ATOM 643 CA VAL A 786 21.349 -5.954 -39.477 1.00 29.49 C ATOM 644 C VAL A 786 20.662 -7.027 -40.310 1.00 25.57 C ATOM 645 O VAL A 786 19.434 -7.018 -40.456 1.00 23.46 O ATOM 646 CB VAL A 786 20.911 -6.016 -38.004 1.00 27.82 C ATOM 647 CG1 VAL A 786 21.086 -7.412 -37.437 1.00 30.47 C ATOM 648 CG2 VAL A 786 21.714 -5.026 -37.178 1.00 27.65 C ATOM 649 H VAL A 786 20.136 -4.200 -39.827 1.00 0.00 H ATOM 650 N ALA A 787 21.455 -7.938 -40.873 1.00 30.10 N ATOM 651 CA ALA A 787 20.917 -9.062 -41.627 1.00 29.10 C ATOM 652 C ALA A 787 20.400 -10.131 -40.676 1.00 26.76 C ATOM 653 O ALA A 787 21.052 -10.471 -39.685 1.00 27.39 O ATOM 654 CB ALA A 787 21.982 -9.659 -42.547 1.00 26.48 C ATOM 655 H ALA A 787 22.486 -7.844 -40.771 1.00 0.00 H ATOM 656 N LEU A 788 19.222 -10.661 -40.986 1.00 26.05 N ATOM 657 CA LEU A 788 18.572 -11.651 -40.142 1.00 33.17 C ATOM 658 C LEU A 788 18.701 -13.068 -40.683 1.00 35.23 C ATOM 659 O LEU A 788 18.126 -13.992 -40.099 1.00 32.62 O ATOM 660 CB LEU A 788 17.092 -11.291 -39.962 1.00 31.08 C ATOM 661 CG LEU A 788 16.837 -10.000 -39.174 1.00 33.27 C ATOM 662 CD1 LEU A 788 15.366 -9.652 -39.196 1.00 33.21 C ATOM 663 CD2 LEU A 788 17.322 -10.125 -37.730 1.00 32.89 C ATOM 664 H LEU A 788 18.749 -10.358 -41.861 1.00 0.00 H ATOM 665 N GLN A 789 19.438 -13.260 -41.777 1.00 34.58 N ATOM 666 CA GLN A 789 19.705 -14.596 -42.299 1.00 37.44 C ATOM 667 C GLN A 789 20.375 -15.452 -41.231 1.00 35.85 C ATOM 668 O GLN A 789 21.415 -15.074 -40.684 1.00 34.89 O ATOM 669 CB GLN A 789 20.589 -14.493 -43.544 1.00 49.35 C ATOM 670 CG GLN A 789 21.240 -15.805 -44.011 1.00 68.91 C ATOM 671 CD GLN A 789 20.241 -16.787 -44.602 1.00 69.42 C ATOM 672 OE1 GLN A 789 19.463 -16.437 -45.490 1.00 74.88 O ATOM 673 NE2 GLN A 789 20.258 -18.026 -44.112 1.00 61.25 N ATOM 674 HE22 GLN A 789 20.932 -18.279 -43.362 1.00 0.00 H ATOM 675 HE21 GLN A 789 19.597 -18.740 -44.480 1.00 0.00 H ATOM 676 H GLN A 789 19.833 -12.435 -42.272 1.00 0.00 H ATOM 677 N GLY A 790 19.780 -16.608 -40.937 1.00 36.82 N ATOM 678 CA GLY A 790 20.341 -17.503 -39.942 1.00 33.14 C ATOM 679 C GLY A 790 20.200 -17.033 -38.515 1.00 32.54 C ATOM 680 O GLY A 790 20.818 -17.618 -37.618 1.00 33.06 O ATOM 681 H GLY A 790 18.902 -16.872 -41.427 1.00 0.00 H ATOM 682 N ALA A 791 19.404 -15.995 -38.276 1.00 29.39 N ATOM 683 CA ALA A 791 19.235 -15.467 -36.931 1.00 31.94 C ATOM 684 C ALA A 791 18.374 -16.395 -36.092 1.00 29.06 C ATOM 685 O ALA A 791 17.417 -17.001 -36.583 1.00 26.91 O ATOM 686 CB ALA A 791 18.591 -14.083 -36.979 1.00 32.68 C ATOM 687 H ALA A 791 18.892 -15.552 -39.066 1.00 0.00 H ATOM 688 N GLU A 792 18.713 -16.494 -34.814 1.00 28.11 N ATOM 689 CA GLU A 792 17.854 -17.188 -33.873 1.00 29.95 C ATOM 690 C GLU A 792 16.710 -16.272 -33.463 1.00 25.43 C ATOM 691 O GLU A 792 16.799 -15.045 -33.565 1.00 23.71 O ATOM 692 CB GLU A 792 18.649 -17.644 -32.647 1.00 31.81 C ATOM 693 CG GLU A 792 19.534 -18.867 -32.911 1.00 39.91 C ATOM 694 CD GLU A 792 20.430 -19.235 -31.739 1.00 41.95 C ATOM 695 OE1 GLU A 792 20.227 -18.703 -30.626 1.00 40.31 O ATOM 696 OE2 GLU A 792 21.344 -20.063 -31.938 1.00 42.23 O ATOM 697 H GLU A 792 19.603 -16.070 -34.483 1.00 0.00 H ATOM 698 N HIS A 793 15.617 -16.888 -33.015 1.00 26.51 N ATOM 699 CA HIS A 793 14.434 -16.127 -32.635 1.00 26.96 C ATOM 700 C HIS A 793 14.780 -15.022 -31.647 1.00 25.08 C ATOM 701 O HIS A 793 14.375 -13.868 -31.824 1.00 24.15 O ATOM 702 CB HIS A 793 13.382 -17.070 -32.049 1.00 26.38 C ATOM 703 CG HIS A 793 12.146 -16.373 -31.577 1.00 26.34 C ATOM 704 ND1 HIS A 793 11.055 -16.155 -32.391 1.00 21.62 N ATOM 705 CD2 HIS A 793 11.832 -15.833 -30.376 1.00 23.76 C ATOM 706 CE1 HIS A 793 10.121 -15.516 -31.710 1.00 22.80 C ATOM 707 NE2 HIS A 793 10.568 -15.308 -30.484 1.00 25.51 N ATOM 708 H HIS A 793 15.608 -17.925 -32.936 1.00 0.00 H ATOM 709 N HIS A 794 15.538 -15.353 -30.599 1.00 24.05 N ATOM 710 CA HIS A 794 15.845 -14.354 -29.581 1.00 28.57 C ATOM 711 C HIS A 794 16.786 -13.282 -30.119 1.00 28.13 C ATOM 712 O HIS A 794 16.762 -12.143 -29.640 1.00 27.09 O ATOM 713 CB HIS A 794 16.443 -15.030 -28.343 1.00 26.93 C ATOM 714 CG HIS A 794 17.877 -15.430 -28.503 1.00 32.66 C ATOM 715 ND1 HIS A 794 18.924 -14.615 -28.126 1.00 31.70 N ATOM 716 CD2 HIS A 794 18.438 -16.554 -29.008 1.00 28.96 C ATOM 717 CE1 HIS A 794 20.068 -15.223 -28.389 1.00 31.40 C ATOM 718 NE2 HIS A 794 19.800 -16.400 -28.925 1.00 38.62 N ATOM 719 H HIS A 794 15.909 -16.320 -30.509 1.00 0.00 H ATOM 720 N GLU A 795 17.605 -13.618 -31.121 1.00 26.83 N ATOM 721 CA GLU A 795 18.479 -12.618 -31.724 1.00 26.41 C ATOM 722 C GLU A 795 17.674 -11.582 -32.497 1.00 27.28 C ATOM 723 O GLU A 795 17.951 -10.380 -32.412 1.00 25.34 O ATOM 724 CB GLU A 795 19.499 -13.298 -32.636 1.00 27.07 C ATOM 725 CG GLU A 795 20.541 -14.112 -31.891 1.00 32.48 C ATOM 726 CD GLU A 795 21.499 -14.832 -32.824 1.00 36.83 C ATOM 727 OE1 GLU A 795 21.046 -15.341 -33.870 1.00 33.43 O ATOM 728 OE2 GLU A 795 22.706 -14.885 -32.513 1.00 47.77 O ATOM 729 H GLU A 795 17.619 -14.597 -31.472 1.00 0.00 H ATOM 730 N ALA A 796 16.674 -12.026 -33.260 1.00 29.32 N ATOM 731 CA ALA A 796 15.822 -11.087 -33.979 1.00 24.66 C ATOM 732 C ALA A 796 15.007 -10.236 -33.014 1.00 24.47 C ATOM 733 O ALA A 796 14.824 -9.035 -33.242 1.00 22.27 O ATOM 734 CB ALA A 796 14.908 -11.846 -34.937 1.00 24.04 C ATOM 735 H ALA A 796 16.501 -13.048 -33.342 1.00 0.00 H ATOM 736 N VAL A 797 14.516 -10.838 -31.926 1.00 26.81 N ATOM 737 CA VAL A 797 13.794 -10.073 -30.910 1.00 24.76 C ATOM 738 C VAL A 797 14.680 -8.963 -30.355 1.00 24.43 C ATOM 739 O VAL A 797 14.253 -7.809 -30.236 1.00 22.43 O ATOM 740 CB VAL A 797 13.283 -11.013 -29.798 1.00 26.95 C ATOM 741 CG1 VAL A 797 13.011 -10.260 -28.477 1.00 23.40 C ATOM 742 CG2 VAL A 797 12.012 -11.724 -30.252 1.00 28.98 C ATOM 743 H VAL A 797 14.649 -11.862 -31.801 1.00 0.00 H ATOM 744 N GLU A 798 15.932 -9.290 -30.027 1.00 22.90 N ATOM 745 CA GLU A 798 16.831 -8.308 -29.427 1.00 25.61 C ATOM 746 C GLU A 798 17.190 -7.208 -30.414 1.00 24.10 C ATOM 747 O GLU A 798 17.259 -6.030 -30.043 1.00 23.16 O ATOM 748 CB GLU A 798 18.096 -9.001 -28.918 1.00 27.86 C ATOM 749 CG GLU A 798 17.946 -9.634 -27.536 1.00 36.21 C ATOM 750 CD GLU A 798 18.841 -10.847 -27.327 1.00 48.18 C ATOM 751 OE1 GLU A 798 18.513 -11.683 -26.454 1.00 48.31 O ATOM 752 OE2 GLU A 798 19.866 -10.967 -28.033 1.00 47.80 O ATOM 753 H GLU A 798 16.272 -10.257 -30.201 1.00 0.00 H ATOM 754 N ALA A 799 17.423 -7.568 -31.676 1.00 25.91 N ATOM 755 CA ALA A 799 17.687 -6.549 -32.683 1.00 21.64 C ATOM 756 C ALA A 799 16.510 -5.590 -32.803 1.00 24.91 C ATOM 757 O ALA A 799 16.698 -4.383 -32.990 1.00 27.11 O ATOM 758 CB ALA A 799 17.991 -7.205 -34.029 1.00 23.78 C ATOM 759 H ALA A 799 17.416 -8.574 -31.941 1.00 0.00 H ATOM 760 N LEU A 800 15.285 -6.105 -32.662 1.00 24.57 N ATOM 761 CA LEU A 800 14.101 -5.278 -32.870 1.00 21.77 C ATOM 762 C LEU A 800 13.768 -4.447 -31.638 1.00 24.52 C ATOM 763 O LEU A 800 13.408 -3.271 -31.764 1.00 23.39 O ATOM 764 CB LEU A 800 12.912 -6.157 -33.265 1.00 24.52 C ATOM 765 CG LEU A 800 12.970 -6.620 -34.723 1.00 26.73 C ATOM 766 CD1 LEU A 800 12.056 -7.807 -34.959 1.00 28.16 C ATOM 767 CD2 LEU A 800 12.615 -5.478 -35.674 1.00 23.65 C ATOM 768 H LEU A 800 15.174 -7.106 -32.401 1.00 0.00 H ATOM 769 N ARG A 801 13.879 -5.028 -30.442 1.00 20.72 N ATOM 770 CA ARG A 801 13.606 -4.250 -29.239 1.00 23.91 C ATOM 771 C ARG A 801 14.602 -3.109 -29.088 1.00 23.86 C ATOM 772 O ARG A 801 14.255 -2.050 -28.549 1.00 22.71 O ATOM 773 CB ARG A 801 13.625 -5.152 -28.000 1.00 24.67 C ATOM 774 CG ARG A 801 12.608 -6.293 -28.059 1.00 27.97 C ATOM 775 CD ARG A 801 12.026 -6.659 -26.694 1.00 23.14 C ATOM 776 NE ARG A 801 12.658 -7.836 -26.109 1.00 26.37 N ATOM 777 CZ ARG A 801 12.021 -8.922 -25.664 1.00 29.46 C ATOM 778 NH1 ARG A 801 10.698 -9.026 -25.704 1.00 25.02 N ATOM 779 NH2 ARG A 801 12.724 -9.923 -25.159 1.00 26.77 N ATOM 780 HE ARG A 801 13.695 -7.829 -26.032 1.00 0.00 H ATOM 781 HH12 ARG A 801 10.233 -9.886 -25.349 1.00 0.00 H ATOM 782 HH11 ARG A 801 10.127 -8.248 -26.090 1.00 0.00 H ATOM 783 HH22 ARG A 801 12.240 -10.774 -24.809 1.00 0.00 H ATOM 784 HH21 ARG A 801 13.761 -9.859 -25.112 1.00 0.00 H ATOM 785 H ARG A 801 14.158 -6.027 -30.368 1.00 0.00 H ATOM 786 N GLY A 802 15.826 -3.290 -29.580 1.00 24.77 N ATOM 787 CA GLY A 802 16.836 -2.250 -29.505 1.00 27.00 C ATOM 788 C GLY A 802 17.057 -1.508 -30.812 1.00 28.61 C ATOM 789 O GLY A 802 18.135 -0.949 -31.033 1.00 29.31 O ATOM 790 H GLY A 802 16.064 -4.198 -30.028 1.00 0.00 H ATOM 791 N ALA A 803 16.049 -1.488 -31.687 1.00 23.43 N ATOM 792 CA ALA A 803 16.191 -0.825 -32.978 1.00 30.26 C ATOM 793 C ALA A 803 15.958 0.680 -32.912 1.00 31.13 C ATOM 794 O ALA A 803 16.315 1.384 -33.862 1.00 28.97 O ATOM 795 CB ALA A 803 15.232 -1.446 -33.999 1.00 26.60 C ATOM 796 H ALA A 803 15.150 -1.952 -31.445 1.00 0.00 H ATOM 797 N GLY A 804 15.370 1.189 -31.837 1.00 30.25 N ATOM 798 CA GLY A 804 15.212 2.620 -31.676 1.00 29.60 C ATOM 799 C GLY A 804 13.896 3.146 -32.221 1.00 30.43 C ATOM 800 O GLY A 804 12.916 2.421 -32.419 1.00 31.91 O ATOM 801 H GLY A 804 15.016 0.549 -31.097 1.00 0.00 H ATOM 802 N THR A 805 13.890 4.458 -32.467 1.00 29.02 N ATOM 803 CA THR A 805 12.657 5.154 -32.824 1.00 29.28 C ATOM 804 C THR A 805 12.156 4.752 -34.206 1.00 28.89 C ATOM 805 O THR A 805 10.956 4.519 -34.392 1.00 28.82 O ATOM 806 CB THR A 805 12.888 6.663 -32.764 1.00 30.14 C ATOM 807 OG1 THR A 805 13.354 7.020 -31.456 1.00 39.12 O ATOM 808 CG2 THR A 805 11.603 7.426 -33.074 1.00 38.47 C ATOM 809 HG1 THR A 805 14.203 6.547 -31.269 1.00 0.00 H ATOM 810 H THR A 805 14.779 4.994 -32.403 1.00 0.00 H ATOM 811 N ALA A 806 13.047 4.695 -35.192 1.00 25.48 N ATOM 812 CA ALA A 806 12.684 4.360 -36.563 1.00 26.66 C ATOM 813 C ALA A 806 13.222 2.975 -36.898 1.00 27.82 C ATOM 814 O ALA A 806 14.434 2.742 -36.832 1.00 24.68 O ATOM 815 CB ALA A 806 13.232 5.401 -37.539 1.00 25.62 C ATOM 816 H ALA A 806 14.044 4.898 -34.976 1.00 0.00 H ATOM 817 N VAL A 807 12.323 2.068 -37.271 1.00 25.49 N ATOM 818 CA VAL A 807 12.677 0.684 -37.561 1.00 25.24 C ATOM 819 C VAL A 807 12.407 0.461 -39.044 1.00 26.67 C ATOM 820 O VAL A 807 11.264 0.225 -39.455 1.00 23.91 O ATOM 821 CB VAL A 807 11.903 -0.309 -36.688 1.00 21.45 C ATOM 822 CG1 VAL A 807 12.421 -1.715 -36.917 1.00 25.22 C ATOM 823 CG2 VAL A 807 12.027 0.072 -35.215 1.00 25.67 C ATOM 824 H VAL A 807 11.328 2.358 -37.359 1.00 0.00 H ATOM 825 N GLN A 808 13.461 0.541 -39.849 1.00 23.66 N ATOM 826 CA GLN A 808 13.383 0.310 -41.284 1.00 28.98 C ATOM 827 C GLN A 808 13.770 -1.132 -41.563 1.00 25.97 C ATOM 828 O GLN A 808 14.835 -1.585 -41.133 1.00 23.49 O ATOM 829 CB GLN A 808 14.305 1.268 -42.037 1.00 27.76 C ATOM 830 CG GLN A 808 14.498 0.950 -43.505 1.00 33.39 C ATOM 831 CD GLN A 808 15.188 2.085 -44.237 1.00 33.87 C ATOM 832 OE1 GLN A 808 16.416 2.166 -44.269 1.00 38.82 O ATOM 833 NE2 GLN A 808 14.399 2.982 -44.812 1.00 32.15 N ATOM 834 HE22 GLN A 808 13.366 2.875 -44.761 1.00 0.00 H ATOM 835 HE21 GLN A 808 14.813 3.793 -45.314 1.00 0.00 H ATOM 836 H GLN A 808 14.385 0.780 -39.435 1.00 0.00 H ATOM 837 N MET A 809 12.900 -1.859 -42.258 1.00 31.58 N ATOM 838 CA MET A 809 13.127 -3.275 -42.483 1.00 31.35 C ATOM 839 C MET A 809 12.907 -3.637 -43.942 1.00 31.50 C ATOM 840 O MET A 809 12.070 -3.051 -44.636 1.00 29.98 O ATOM 841 CB MET A 809 12.227 -4.142 -41.594 1.00 27.18 C ATOM 842 CG MET A 809 10.833 -3.589 -41.328 1.00 39.92 C ATOM 843 SD MET A 809 9.847 -4.703 -40.290 1.00 40.98 S ATOM 844 CE MET A 809 10.998 -5.081 -38.970 1.00 26.49 C ATOM 845 H MET A 809 12.047 -1.408 -42.645 1.00 0.00 H ATOM 846 N ARG A 810 13.685 -4.617 -44.389 1.00 30.08 N ATOM 847 CA ARG A 810 13.568 -5.191 -45.720 1.00 33.43 C ATOM 848 C ARG A 810 12.855 -6.529 -45.580 1.00 29.86 C ATOM 849 O ARG A 810 13.315 -7.397 -44.832 1.00 30.45 O ATOM 850 CB ARG A 810 14.953 -5.366 -46.346 1.00 37.34 C ATOM 851 CG ARG A 810 14.963 -5.503 -47.857 1.00 44.61 C ATOM 852 CD ARG A 810 16.336 -5.154 -48.435 1.00 55.48 C ATOM 853 NE ARG A 810 17.432 -5.830 -47.735 1.00 61.53 N ATOM 854 CZ ARG A 810 17.881 -7.053 -48.018 1.00 61.81 C ATOM 855 NH1 ARG A 810 17.334 -7.770 -48.992 1.00 56.32 N ATOM 856 NH2 ARG A 810 18.884 -7.569 -47.319 1.00 58.02 N ATOM 857 HE ARG A 810 17.895 -5.316 -46.958 1.00 0.00 H ATOM 858 HH12 ARG A 810 17.694 -8.723 -49.202 1.00 0.00 H ATOM 859 HH11 ARG A 810 16.545 -7.379 -49.545 1.00 0.00 H ATOM 860 HH22 ARG A 810 19.235 -8.523 -47.539 1.00 0.00 H ATOM 861 HH21 ARG A 810 19.319 -7.019 -46.551 1.00 0.00 H ATOM 862 H ARG A 810 14.417 -4.994 -43.753 1.00 0.00 H ATOM 863 N VAL A 811 11.735 -6.696 -46.288 1.00 29.45 N ATOM 864 CA VAL A 811 10.917 -7.892 -46.144 1.00 29.25 C ATOM 865 C VAL A 811 10.669 -8.550 -47.496 1.00 31.29 C ATOM 866 O VAL A 811 10.710 -7.914 -48.552 1.00 28.45 O ATOM 867 CB VAL A 811 9.568 -7.595 -45.451 1.00 28.00 C ATOM 868 CG1 VAL A 811 9.795 -6.839 -44.160 1.00 28.62 C ATOM 869 CG2 VAL A 811 8.635 -6.814 -46.360 1.00 28.15 C ATOM 870 H VAL A 811 11.441 -5.956 -46.957 1.00 0.00 H ATOM 871 N TRP A 812 10.398 -9.853 -47.438 1.00 30.57 N ATOM 872 CA TRP A 812 9.959 -10.635 -48.584 1.00 27.68 C ATOM 873 C TRP A 812 8.495 -11.014 -48.400 1.00 31.22 C ATOM 874 O TRP A 812 8.105 -11.509 -47.337 1.00 30.28 O ATOM 875 CB TRP A 812 10.815 -11.888 -48.748 1.00 30.66 C ATOM 876 CG TRP A 812 10.465 -12.707 -49.953 1.00 34.96 C ATOM 877 CD1 TRP A 812 9.770 -13.881 -49.974 1.00 37.60 C ATOM 878 CD2 TRP A 812 10.794 -12.412 -51.315 1.00 37.87 C ATOM 879 NE1 TRP A 812 9.651 -14.338 -51.265 1.00 42.64 N ATOM 880 CE2 TRP A 812 10.269 -13.453 -52.107 1.00 40.99 C ATOM 881 CE3 TRP A 812 11.484 -11.369 -51.943 1.00 34.83 C ATOM 882 CZ2 TRP A 812 10.410 -13.480 -53.494 1.00 47.28 C ATOM 883 CZ3 TRP A 812 11.622 -11.399 -53.321 1.00 39.87 C ATOM 884 CH2 TRP A 812 11.088 -12.446 -54.080 1.00 42.97 C ATOM 885 HE1 TRP A 812 9.170 -15.213 -51.555 1.00 0.00 H ATOM 886 H TRP A 812 10.506 -10.338 -46.524 1.00 0.00 H ATOM 887 N ARG A 813 7.693 -10.793 -49.439 1.00 33.09 N ATOM 888 CA ARG A 813 6.246 -10.948 -49.363 1.00 32.32 C ATOM 889 C ARG A 813 5.761 -11.779 -50.541 1.00 35.52 C ATOM 890 O ARG A 813 5.996 -11.417 -51.698 1.00 35.26 O ATOM 891 CB ARG A 813 5.560 -9.580 -49.354 1.00 29.05 C ATOM 892 CG ARG A 813 4.053 -9.637 -49.322 1.00 26.09 C ATOM 893 CD ARG A 813 3.466 -8.242 -49.254 1.00 28.22 C ATOM 894 NE ARG A 813 3.831 -7.559 -48.018 1.00 34.63 N ATOM 895 CZ ARG A 813 3.574 -6.282 -47.761 1.00 35.03 C ATOM 896 NH1 ARG A 813 2.944 -5.534 -48.657 1.00 35.17 N ATOM 897 NH2 ARG A 813 3.947 -5.753 -46.604 1.00 31.36 N ATOM 898 HE ARG A 813 4.326 -8.110 -47.288 1.00 0.00 H ATOM 899 HH12 ARG A 813 2.745 -4.534 -48.452 1.00 0.00 H ATOM 900 HH11 ARG A 813 2.649 -5.947 -49.565 1.00 0.00 H ATOM 901 HH22 ARG A 813 3.747 -4.753 -46.401 1.00 0.00 H ATOM 902 HH21 ARG A 813 4.440 -6.338 -45.900 1.00 0.00 H ATOM 903 H ARG A 813 8.116 -10.498 -50.342 1.00 0.00 H ATOM 904 N GLU A 814 5.078 -12.879 -50.243 1.00 41.48 N ATOM 905 CA GLU A 814 4.460 -13.733 -51.245 1.00 46.47 C ATOM 906 C GLU A 814 2.943 -13.594 -51.194 1.00 50.50 C ATOM 907 O GLU A 814 2.368 -13.125 -50.208 1.00 51.69 O ATOM 908 CB GLU A 814 4.865 -15.194 -51.033 1.00 47.65 C ATOM 909 CG GLU A 814 5.954 -15.666 -51.977 1.00 56.72 C ATOM 910 CD GLU A 814 6.919 -16.623 -51.315 1.00 67.15 C ATOM 911 OE1 GLU A 814 8.120 -16.587 -51.659 1.00 67.44 O ATOM 912 OE2 GLU A 814 6.477 -17.404 -50.446 1.00 73.45 O ATOM 913 H GLU A 814 4.980 -13.143 -49.242 1.00 0.00 H ATOM 914 N ARG A 815 2.300 -14.003 -52.282 1.00 55.54 N ATOM 915 CA ARG A 815 0.850 -13.933 -52.390 1.00 53.51 C ATOM 916 C ARG A 815 0.208 -15.074 -51.605 1.00 69.32 C ATOM 917 O ARG A 815 -0.719 -14.868 -50.818 1.00 77.45 O ATOM 918 CB ARG A 815 0.424 -13.987 -53.858 1.00 59.99 C ATOM 919 CG ARG A 815 -1.071 -13.868 -54.070 1.00 74.38 C ATOM 920 CD ARG A 815 -1.417 -13.632 -55.533 1.00 79.23 C ATOM 921 NE ARG A 815 -2.851 -13.422 -55.720 1.00 94.89 N ATOM 922 CZ ARG A 815 -3.485 -12.284 -55.451 1.00 92.95 C ATOM 923 NH1 ARG A 815 -2.819 -11.239 -54.978 1.00 91.42 N ATOM 924 NH2 ARG A 815 -4.792 -12.188 -55.652 1.00 96.12 N ATOM 925 HE ARG A 815 -3.414 -14.215 -56.088 1.00 0.00 H ATOM 926 HH12 ARG A 815 -3.322 -10.353 -54.770 1.00 0.00 H ATOM 927 HH11 ARG A 815 -1.794 -11.306 -54.815 1.00 0.00 H ATOM 928 HH22 ARG A 815 -5.287 -11.298 -55.441 1.00 0.00 H ATOM 929 HH21 ARG A 815 -5.323 -13.003 -56.020 1.00 0.00 H ATOM 930 H ARG A 815 2.848 -14.384 -53.079 1.00 0.00 H TER 931 ARG A 815 HETATM 932 O HOH 1 0.500 -12.363 -30.107 1.00 41.52 O HETATM 933 O HOH 2 7.038 -13.857 -47.278 1.00 35.28 O HETATM 934 O HOH 3 2.596 -2.993 -48.205 1.00 34.22 O HETATM 935 O HOH 4 10.543 -19.758 -39.087 1.00 23.48 O HETATM 936 O HOH 5 2.779 -11.090 -46.128 1.00 27.11 O HETATM 937 O HOH 6 1.164 -15.908 -42.738 1.00 33.88 O HETATM 938 O HOH 7 12.597 -22.361 -37.384 1.00 41.78 O HETATM 939 O HOH 8 9.852 -20.315 -33.909 1.00 19.77 O HETATM 940 O HOH 9 2.156 7.646 -25.611 1.00 65.86 O HETATM 941 O HOH 10 15.204 -22.444 -43.342 1.00 43.08 O HETATM 942 O HOH 11 -2.925 -16.483 -50.812 1.00 50.99 O HETATM 943 O HOH 12 16.092 -17.208 -39.097 1.00 32.36 O HETATM 944 O HOH 13 4.631 3.869 -38.635 1.00 32.60 O HETATM 945 O HOH 14 -0.252 -2.588 -43.096 1.00 35.76 O HETATM 946 O HOH 15 14.610 -14.215 -41.980 1.00 24.80 O HETATM 947 O HOH 16 0.815 -2.441 -36.259 1.00 34.29 O HETATM 948 O HOH 17 13.834 -27.000 -38.658 1.00 49.63 O HETATM 949 O HOH 18 12.197 -1.551 -26.745 1.00 29.12 O HETATM 950 O HOH 19 8.860 -1.067 -27.621 1.00 34.51 O HETATM 951 O HOH 20 18.662 0.122 -34.704 1.00 20.10 O HETATM 952 O HOH 21 3.497 -23.604 -39.638 1.00 43.18 O HETATM 953 O HOH 22 3.893 -24.855 -41.847 1.00 45.05 O HETATM 954 O HOH 23 -1.572 -8.136 -42.219 1.00 35.18 O HETATM 955 O HOH 24 14.818 0.716 -28.975 1.00 28.39 O HETATM 956 O HOH 25 -2.547 -9.611 -37.474 1.00 26.94 O HETATM 957 O HOH 26 -3.298 -8.994 -27.120 1.00 43.69 O HETATM 958 O HOH 27 1.902 -20.205 -40.426 1.00 44.30 O HETATM 959 O HOH 28 1.641 -5.710 -51.293 1.00 48.58 O HETATM 960 O HOH 29 9.903 -24.401 -46.536 1.00 47.32 O HETATM 961 O HOH 30 7.582 -16.149 -47.962 1.00 42.09 O HETATM 962 O HOH 31 3.951 -13.585 -47.552 1.00 28.31 O HETATM 963 O HOH 32 -4.277 -6.835 -67.407 1.00 39.57 O HETATM 964 O HOH 33 1.271 -7.630 -32.411 1.00 42.83 O HETATM 965 O HOH 34 7.010 2.318 -44.972 1.00 43.46 O HETATM 966 O HOH 35 23.098 -16.188 -36.058 1.00 49.40 O HETATM 967 O HOH 36 -1.529 -11.061 -45.085 1.00 44.40 O HETATM 968 O HOH 37 15.373 -12.431 -26.262 1.00 35.36 O HETATM 969 O HOH 38 14.646 5.188 -29.115 1.00 39.15 O HETATM 970 O HOH 39 19.321 0.404 -28.280 1.00 37.72 O HETATM 971 O HOH 40 11.332 -25.890 -31.220 1.00 31.79 O HETATM 972 O HOH 41 -12.815 -6.736 -72.680 1.00 55.52 O HETATM 973 O HOH 42 23.367 -18.052 -34.567 1.00 51.57 O HETATM 974 O HOH 43 -2.270 -4.789 -41.782 1.00 44.42 O HETATM 975 O HOH 44 12.804 -23.985 -46.708 1.00 50.09 O HETATM 976 O HOH 45 14.273 8.372 -28.113 1.00 52.58 O HETATM 977 O HOH 46 0.559 -10.006 -53.024 1.00 52.62 O HETATM 978 O HOH 47 0.251 -14.103 -47.216 1.00 40.97 O HETATM 979 O HOH 48 -12.053 -9.630 -74.851 1.00 52.46 O HETATM 980 O HOH 49 15.971 -15.775 -43.769 1.00 39.04 O HETATM 981 O HOH 50 2.391 -17.757 -44.052 1.00 45.55 O HETATM 982 O HOH 51 -8.982 5.638 -37.268 1.00 57.53 O HETATM 983 O HOH 52 1.631 -21.346 -43.004 1.00 51.84 O HETATM 984 O HOH 53 11.778 -3.599 -25.348 1.00 40.85 O HETATM 985 O HOH 54 19.446 -4.049 -53.499 1.00 54.51 O HETATM 986 O HOH 55 5.964 11.814 -30.418 1.00 56.01 O HETATM 987 O HOH 56 -14.731 -9.431 -78.236 1.00 56.16 O HETATM 988 O HOH 57 -12.371 -3.856 -66.196 1.00 56.68 O HETATM 989 O HOH 58 -12.085 -5.234 -76.155 1.00 50.49 O HETATM 990 O HOH 59 11.314 -22.701 -29.189 1.00 26.90 O HETATM 991 O HOH 60 8.754 -6.945 -26.663 1.00 33.17 O HETATM 992 O HOH 61 11.883 -18.325 -28.076 1.00 29.99 O HETATM 993 O HOH 62 9.685 -3.511 -29.695 1.00 27.63 O HETATM 994 O HOH 63 2.205 -14.451 -28.225 1.00 42.59 O HETATM 995 O HOH 64 6.666 -18.404 -27.650 1.00 25.96 O HETATM 996 O HOH 65 5.567 -10.875 -26.126 1.00 30.89 O HETATM 997 O HOH 66 9.522 -23.594 -31.239 1.00 25.91 O HETATM 998 O HOH 67 5.259 -5.373 -26.409 1.00 38.93 O HETATM 999 N PRO A 68 7.209 -28.475 -30.819 1.00 0.25 N HETATM 1000 CA PRO A 68 6.402 -27.400 -30.238 1.00 0.07 C HETATM 1001 C PRO A 68 5.814 -26.489 -31.299 1.00 0.23 C HETATM 1002 O PRO A 68 6.212 -26.541 -32.466 1.00 -0.39 O HETATM 1003 N PRO A 68 4.855 -25.667 -30.892 1.00 -0.26 N HETATM 1004 CA PRO A 68 4.433 -24.577 -31.748 1.00 0.13 C HETATM 1005 C PRO A 68 5.616 -23.649 -31.995 1.00 0.20 C HETATM 1006 O PRO A 68 6.595 -23.634 -31.243 1.00 -0.39 O HETATM 1007 N PRO A 68 5.530 -22.870 -33.065 1.00 -0.26 N HETATM 1008 CA PRO A 68 6.547 -21.852 -33.273 1.00 0.14 C HETATM 1009 C PRO A 68 6.433 -20.776 -32.198 1.00 0.21 C HETATM 1010 O PRO A 68 5.360 -20.537 -31.638 1.00 -0.39 O HETATM 1011 N PRO A 68 7.567 -20.153 -31.885 1.00 -0.26 N HETATM 1012 CA PRO A 68 7.613 -19.079 -30.902 1.00 0.14 C HETATM 1013 C PRO A 68 7.048 -17.786 -31.476 1.00 0.21 C HETATM 1014 O PRO A 68 7.162 -17.506 -32.672 1.00 -0.39 O HETATM 1015 N PRO A 68 6.444 -16.989 -30.599 1.00 -0.26 N HETATM 1016 CA PRO A 68 5.903 -15.692 -30.972 1.00 0.13 C HETATM 1017 C PRO A 68 6.257 -14.682 -29.893 1.00 0.20 C HETATM 1018 O PRO A 68 6.065 -14.950 -28.703 1.00 -0.39 O HETATM 1019 N PRO A 68 6.776 -13.531 -30.311 1.00 -0.26 N HETATM 1020 CA PRO A 68 7.116 -12.448 -29.399 1.00 0.16 C HETATM 1021 C PRO A 68 6.458 -11.167 -29.888 1.00 0.21 C HETATM 1022 O PRO A 68 6.522 -10.849 -31.079 1.00 -0.39 O HETATM 1023 N PRO A 68 5.824 -10.444 -28.972 1.00 -0.26 N HETATM 1024 CA PRO A 68 5.208 -9.164 -29.291 1.00 0.15 C HETATM 1025 C PRO A 68 6.234 -8.046 -29.193 1.00 0.21 C HETATM 1026 O PRO A 68 7.032 -7.994 -28.252 1.00 -0.39 O HETATM 1027 N PRO A 68 6.195 -7.146 -30.167 1.00 -0.27 N HETATM 1028 CA PRO A 68 7.104 -6.008 -30.201 1.00 0.09 C HETATM 1029 C PRO A 68 6.361 -4.699 -30.423 1.00 0.06 C HETATM 1030 O PRO A 68 6.963 -3.626 -30.397 1.00 -0.57 O HETATM 1031 OXT PRO A 68 5.149 -4.679 -30.649 1.00 -0.57 O HETATM 1032 CB PRO A 68 8.140 -6.198 -31.303 1.00 -0.02 C HETATM 1033 CG PRO A 68 8.926 -7.504 -31.237 1.00 -0.04 C HETATM 1034 CD1 PRO A 68 9.620 -7.774 -32.561 1.00 -0.06 C HETATM 1035 H53 PRO A 68 10.181 -8.718 -32.495 1.00 0.02 H HETATM 1036 H54 PRO A 68 10.313 -6.950 -32.786 1.00 0.02 H HETATM 1037 H55 PRO A 68 8.868 -7.849 -33.360 1.00 0.02 H HETATM 1038 CD2 PRO A 68 9.932 -7.441 -30.105 1.00 -0.06 C HETATM 1039 H56 PRO A 68 9.407 -7.245 -29.158 1.00 0.02 H HETATM 1040 H57 PRO A 68 10.652 -6.633 -30.299 1.00 0.02 H HETATM 1041 H58 PRO A 68 10.467 -8.400 -30.036 1.00 0.02 H HETATM 1042 H52 PRO A 68 8.224 -8.327 -31.037 1.00 0.03 H HETATM 1043 H50 PRO A 68 8.857 -5.366 -31.243 1.00 0.03 H HETATM 1044 H51 PRO A 68 7.618 -6.163 -32.271 1.00 0.03 H HETATM 1045 H49 PRO A 68 7.624 -5.952 -29.233 1.00 0.07 H HETATM 1046 H48 PRO A 68 5.522 -7.252 -30.899 1.00 0.19 H HETATM 1047 CB PRO A 68 4.037 -8.870 -28.351 1.00 0.08 C HETATM 1048 CG PRO A 68 3.002 -9.975 -28.352 1.00 0.18 C HETATM 1049 OD1 PRO A 68 2.942 -10.786 -29.279 1.00 -0.40 O HETATM 1050 ND2 PRO A 68 2.172 -10.011 -27.317 1.00 -0.30 N HETATM 1051 H46 PRO A 68 1.468 -10.719 -27.265 1.00 0.18 H HETATM 1052 H47 PRO A 68 2.251 -9.330 -26.589 1.00 0.18 H HETATM 1053 H44 PRO A 68 3.555 -7.934 -28.670 1.00 0.06 H HETATM 1054 H45 PRO A 68 4.426 -8.752 -27.329 1.00 0.06 H HETATM 1055 H43 PRO A 68 4.828 -9.207 -30.323 1.00 0.08 H HETATM 1056 H42 PRO A 68 5.768 -10.789 -28.035 1.00 0.19 H HETATM 1057 CB PRO A 68 8.636 -12.272 -29.299 1.00 0.09 C HETATM 1058 OG1 PRO A 68 9.241 -13.522 -28.944 1.00 -0.39 O HETATM 1059 H38 PRO A 68 9.040 -14.170 -29.609 1.00 0.21 H HETATM 1060 CG2 PRO A 68 8.994 -11.216 -28.254 1.00 -0.03 C HETATM 1061 H39 PRO A 68 10.087 -11.108 -28.201 1.00 0.03 H HETATM 1062 H40 PRO A 68 8.608 -11.527 -27.272 1.00 0.03 H HETATM 1063 H41 PRO A 68 8.544 -10.253 -28.537 1.00 0.03 H HETATM 1064 H37 PRO A 68 9.022 -11.950 -30.277 1.00 0.06 H HETATM 1065 H36 PRO A 68 6.726 -12.690 -28.399 1.00 0.08 H HETATM 1066 H35 PRO A 68 6.939 -13.405 -31.290 1.00 0.19 H HETATM 1067 CB PRO A 68 4.384 -15.756 -31.160 1.00 -0.00 C HETATM 1068 CG PRO A 68 3.771 -14.430 -31.548 1.00 0.00 C HETATM 1069 CD PRO A 68 2.302 -14.547 -31.876 1.00 0.04 C HETATM 1070 OE1 PRO A 68 1.936 -14.409 -33.065 1.00 -0.57 O HETATM 1071 OE2 PRO A 68 1.518 -14.782 -30.936 1.00 -0.57 O HETATM 1072 H33 PRO A 68 4.300 -14.042 -32.431 1.00 0.04 H HETATM 1073 H34 PRO A 68 3.891 -13.727 -30.710 1.00 0.04 H HETATM 1074 H31 PRO A 68 3.929 -16.087 -30.215 1.00 0.03 H HETATM 1075 H32 PRO A 68 4.161 -16.488 -31.950 1.00 0.03 H HETATM 1076 H30 PRO A 68 6.360 -15.377 -31.922 1.00 0.08 H HETATM 1077 H29 PRO A 68 6.359 -17.292 -29.650 1.00 0.19 H HETATM 1078 CB PRO A 68 9.048 -18.826 -30.435 1.00 0.04 C HETATM 1079 CG PRO A 68 9.514 -19.829 -29.402 1.00 0.04 C HETATM 1080 OD1 PRO A 68 10.694 -20.232 -29.464 1.00 -0.57 O HETATM 1081 OD2 PRO A 68 8.707 -20.205 -28.525 1.00 -0.57 O HETATM 1082 H27 PRO A 68 9.102 -17.819 -29.996 1.00 0.05 H HETATM 1083 H28 PRO A 68 9.716 -18.883 -31.307 1.00 0.05 H HETATM 1084 H26 PRO A 68 7.005 -19.377 -30.035 1.00 0.08 H HETATM 1085 H25 PRO A 68 8.414 -20.431 -32.339 1.00 0.19 H HETATM 1086 CB PRO A 68 6.443 -21.233 -34.671 1.00 0.00 C HETATM 1087 CG PRO A 68 5.055 -21.040 -35.229 1.00 -0.04 C HETATM 1088 CD1 PRO A 68 4.397 -21.872 -36.096 1.00 0.02 C HETATM 1089 NE1 PRO A 68 3.161 -21.357 -36.400 1.00 -0.29 N HETATM 1090 CE2 PRO A 68 2.996 -20.172 -35.733 1.00 0.06 C HETATM 1091 CD2 PRO A 68 4.170 -19.938 -34.985 1.00 -0.02 C HETATM 1092 CE3 PRO A 68 4.256 -18.778 -34.210 1.00 -0.07 C HETATM 1093 CZ3 PRO A 68 3.180 -17.903 -34.203 1.00 -0.08 C HETATM 1094 CH2 PRO A 68 2.027 -18.167 -34.953 1.00 -0.08 C HETATM 1095 CZ2 PRO A 68 1.917 -19.294 -35.722 1.00 -0.04 C HETATM 1096 H22 PRO A 68 1.023 -19.495 -36.301 1.00 0.05 H HETATM 1097 H24 PRO A 68 1.203 -17.463 -34.924 1.00 0.05 H HETATM 1098 H23 PRO A 68 3.232 -16.999 -33.607 1.00 0.05 H HETATM 1099 H21 PRO A 68 5.145 -18.567 -33.627 1.00 0.05 H HETATM 1100 H20 PRO A 68 2.470 -21.791 -37.028 1.00 0.22 H HETATM 1101 H19 PRO A 68 4.796 -22.806 -36.487 1.00 0.08 H HETATM 1102 H17 PRO A 68 6.993 -21.885 -35.365 1.00 0.04 H HETATM 1103 H18 PRO A 68 6.927 -20.246 -34.635 1.00 0.04 H HETATM 1104 H16 PRO A 68 7.534 -22.329 -33.183 1.00 0.08 H HETATM 1105 H15 PRO A 68 4.780 -22.981 -33.717 1.00 0.19 H HETATM 1106 CB PRO A 68 3.285 -23.802 -31.107 1.00 -0.02 C HETATM 1107 H12 PRO A 68 2.981 -22.980 -31.772 1.00 0.03 H HETATM 1108 H13 PRO A 68 3.615 -23.389 -30.142 1.00 0.03 H HETATM 1109 H14 PRO A 68 2.432 -24.477 -30.945 1.00 0.03 H HETATM 1110 H11 PRO A 68 4.091 -24.988 -32.709 1.00 0.08 H HETATM 1111 H10 PRO A 68 4.426 -25.799 -29.999 1.00 0.19 H HETATM 1112 CB PRO A 68 7.403 -26.635 -29.358 1.00 0.01 C HETATM 1113 CG PRO A 68 8.599 -27.489 -29.260 1.00 -0.01 C HETATM 1114 CD PRO A 68 8.634 -28.284 -30.524 1.00 -0.03 C HETATM 1115 H8 PRO A 68 9.136 -27.728 -31.330 1.00 0.08 H HETATM 1116 H9 PRO A 68 9.141 -29.248 -30.373 1.00 0.08 H HETATM 1117 H6 PRO A 68 8.523 -28.157 -28.389 1.00 0.03 H HETATM 1118 H7 PRO A 68 9.505 -26.871 -29.171 1.00 0.03 H HETATM 1119 H4 PRO A 68 6.977 -26.460 -28.359 1.00 0.03 H HETATM 1120 H5 PRO A 68 7.660 -25.671 -29.822 1.00 0.03 H HETATM 1121 H3 PRO A 68 5.586 -27.817 -29.629 1.00 0.11 H HETATM 1122 H1 PRO A 68 7.078 -28.482 -31.818 1.00 0.20 H HETATM 1123 H2 PRO A 68 6.909 -29.357 -30.434 1.00 0.20 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 999 1000 1114 1122 1123 CONECT 1000 999 1001 1112 1121 CONECT 1001 1000 1002 1003 CONECT 1002 1001 CONECT 1003 1001 1004 1111 CONECT 1004 1003 1005 1106 1110 CONECT 1005 1004 1006 1007 CONECT 1006 1005 CONECT 1007 1005 1008 1105 CONECT 1008 1007 1009 1086 1104 CONECT 1009 1008 1010 1011 CONECT 1010 1009 CONECT 1011 1009 1012 1085 CONECT 1012 1011 1013 1078 1084 CONECT 1013 1012 1014 1015 CONECT 1014 1013 CONECT 1015 1013 1016 1077 CONECT 1016 1015 1017 1067 1076 CONECT 1017 1016 1018 1019 CONECT 1018 1017 CONECT 1019 1017 1020 1066 CONECT 1020 1019 1021 1057 1065 CONECT 1021 1020 1022 1023 CONECT 1022 1021 CONECT 1023 1021 1024 1056 CONECT 1024 1023 1025 1047 1055 CONECT 1025 1024 1026 1027 CONECT 1026 1025 CONECT 1027 1025 1028 1046 CONECT 1028 1027 1029 1032 1045 CONECT 1029 1028 1030 1031 CONECT 1030 1029 CONECT 1031 1029 CONECT 1032 1028 1033 1043 1044 CONECT 1033 1032 1034 1038 1042 CONECT 1034 1033 1035 1036 1037 CONECT 1035 1034 CONECT 1036 1034 CONECT 1037 1034 CONECT 1038 1033 1039 1040 1041 CONECT 1039 1038 CONECT 1040 1038 CONECT 1041 1038 CONECT 1042 1033 CONECT 1043 1032 CONECT 1044 1032 CONECT 1045 1028 CONECT 1046 1027 CONECT 1047 1024 1048 1053 1054 CONECT 1048 1047 1049 1050 CONECT 1049 1048 CONECT 1050 1048 1051 1052 CONECT 1051 1050 CONECT 1052 1050 CONECT 1053 1047 CONECT 1054 1047 CONECT 1055 1024 CONECT 1056 1023 CONECT 1057 1020 1058 1060 1064 CONECT 1058 1057 1059 CONECT 1059 1058 CONECT 1060 1057 1061 1062 1063 CONECT 1061 1060 CONECT 1062 1060 CONECT 1063 1060 CONECT 1064 1057 CONECT 1065 1020 CONECT 1066 1019 CONECT 1067 1016 1068 1074 1075 CONECT 1068 1067 1069 1072 1073 CONECT 1069 1068 1070 1071 CONECT 1070 1069 CONECT 1071 1069 CONECT 1072 1068 CONECT 1073 1068 CONECT 1074 1067 CONECT 1075 1067 CONECT 1076 1016 CONECT 1077 1015 CONECT 1078 1012 1079 1082 1083 CONECT 1079 1078 1080 1081 CONECT 1080 1079 CONECT 1081 1079 CONECT 1082 1078 CONECT 1083 1078 CONECT 1084 1012 CONECT 1085 1011 CONECT 1086 1008 1087 1102 1103 CONECT 1087 1086 1088 1091 CONECT 1088 1087 1089 1101 CONECT 1089 1088 1090 1100 CONECT 1090 1089 1091 1095 CONECT 1091 1087 1090 1092 CONECT 1092 1091 1093 1099 CONECT 1093 1092 1094 1098 CONECT 1094 1093 1095 1097 CONECT 1095 1090 1094 1096 CONECT 1096 1095 CONECT 1097 1094 CONECT 1098 1093 CONECT 1099 1092 CONECT 1100 1089 CONECT 1101 1088 CONECT 1102 1086 CONECT 1103 1086 CONECT 1104 1008 CONECT 1105 1007 CONECT 1106 1004 1107 1108 1109 CONECT 1107 1106 CONECT 1108 1106 CONECT 1109 1106 CONECT 1110 1004 CONECT 1111 1003 CONECT 1112 1000 1113 1119 1120 CONECT 1113 1112 1114 1117 1118 CONECT 1114 999 1113 1115 1116 CONECT 1115 1114 CONECT 1116 1114 CONECT 1117 1113 CONECT 1118 1113 CONECT 1119 1112 CONECT 1120 1112 CONECT 1121 1000 CONECT 1122 999 CONECT 1123 999 MASTER 0 0 0 0 0 0 0 0 1122 1 129 8 END
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Related entries of code: 5vwk
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6mtv
RCSB PDB
PDBbind
118aa, >6MTV_1|Chains... at 99%
6mtu
RCSB PDB
PDBbind
118aa, >6MTU_1|Chains... at 99%
6ms1
RCSB PDB
PDBbind
94aa, >6MS1_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1fo0
RCSB PDB
PDBbind
8-mer
1fzj
RCSB PDB
PDBbind
8-mer
1fzm
RCSB PDB
PDBbind
8-mer
1g6r
RCSB PDB
PDBbind
8-mer
1g7q
RCSB PDB
PDBbind
8-mer
1leg
RCSB PDB
PDBbind
8-mer
1lek
RCSB PDB
PDBbind
8-mer
1nlp
RCSB PDB
PDBbind
8-mer
1nzl
RCSB PDB
PDBbind
8-mer
1nzv
RCSB PDB
PDBbind
8-mer
1obx
RCSB PDB
PDBbind
8-mer
1okx
RCSB PDB
PDBbind
8-mer
1p2g
RCSB PDB
PDBbind
8-mer
1pig
RCSB PDB
PDBbind
8-mer
1pz5
RCSB PDB
PDBbind
8-mer
1qja
RCSB PDB
PDBbind
8-mer
1qjb
RCSB PDB
PDBbind
8-mer
1qr3
RCSB PDB
PDBbind
8-mer
1sle
RCSB PDB
PDBbind
8-mer
1tps
RCSB PDB
PDBbind
8-mer
2c1n
RCSB PDB
PDBbind
8-mer
2clv
RCSB PDB
PDBbind
8-mer
2er0
RCSB PDB
PDBbind
8-mer
2er9
RCSB PDB
PDBbind
8-mer
2fo4
RCSB PDB
PDBbind
8-mer
2h6k
RCSB PDB
PDBbind
8-mer
2kbs
RCSB PDB
PDBbind
8-mer
2qbw
RCSB PDB
PDBbind
8-mer
2r03
RCSB PDB
PDBbind
8-mer
2r9b
RCSB PDB
PDBbind
8-mer
2rly
RCSB PDB
PDBbind
8-mer
2rt5
RCSB PDB
PDBbind
8-mer
2v88
RCSB PDB
PDBbind
8-mer
2w16
RCSB PDB
PDBbind
8-mer
2w3o
RCSB PDB
PDBbind
8-mer
2ynn
RCSB PDB
PDBbind
8-mer
2zpk
RCSB PDB
PDBbind
8-mer
3agm
RCSB PDB
PDBbind
8-mer
3av9
RCSB PDB
PDBbind
8-mer
3ava
RCSB PDB
PDBbind
8-mer
3avb
RCSB PDB
PDBbind
8-mer
3avf
RCSB PDB
PDBbind
8-mer
3avg
RCSB PDB
PDBbind
8-mer
3avh
RCSB PDB
PDBbind
8-mer
3avi
RCSB PDB
PDBbind
8-mer
3avj
RCSB PDB
PDBbind
8-mer
3avk
RCSB PDB
PDBbind
8-mer
3avl
RCSB PDB
PDBbind
8-mer
3avm
RCSB PDB
PDBbind
8-mer
3avn
RCSB PDB
PDBbind
8-mer
3drf
RCSB PDB
PDBbind
8-mer
3ds9
RCSB PDB
PDBbind
8-mer
3eyu
RCSB PDB
PDBbind
8-mer
3h85
RCSB PDB
PDBbind
8-mer
3i91
RCSB PDB
PDBbind
8-mer
3jvk
RCSB PDB
PDBbind
8-mer
3kze
RCSB PDB
PDBbind
8-mer
3muk
RCSB PDB
PDBbind
8-mer
3n5e
RCSB PDB
PDBbind
8-mer
3nf3
RCSB PDB
PDBbind
8-mer
3omc
RCSB PDB
PDBbind
8-mer
3omg
RCSB PDB
PDBbind
8-mer
3p9l
RCSB PDB
PDBbind
8-mer
3p9m
RCSB PDB
PDBbind
8-mer
3pab
RCSB PDB
PDBbind
8-mer
3qg6
RCSB PDB
PDBbind
8-mer
3rdv
RCSB PDB
PDBbind
8-mer
3rwh
RCSB PDB
PDBbind
8-mer
3rwj
RCSB PDB
PDBbind
8-mer
3unn
RCSB PDB
PDBbind
8-mer
3uqp
RCSB PDB
PDBbind
8-mer
3uri
RCSB PDB
PDBbind
8-mer
3uyr
RCSB PDB
PDBbind
8-mer
3zev
RCSB PDB
PDBbind
8-mer
3zvy
RCSB PDB
PDBbind
8-mer
3zyr
RCSB PDB
PDBbind
8-mer
4aa1
RCSB PDB
PDBbind
8-mer
4aph
RCSB PDB
PDBbind
8-mer
4apr
RCSB PDB
PDBbind
8-mer
4dv9
RCSB PDB
PDBbind
8-mer
4e67
RCSB PDB
PDBbind
8-mer
4eoy
RCSB PDB
PDBbind
8-mer
4ep2
RCSB PDB
PDBbind
8-mer
4eqj
RCSB PDB
PDBbind
8-mer
4ezr
RCSB PDB
PDBbind
8-mer
4fmo
RCSB PDB
PDBbind
8-mer
4fn5
RCSB PDB
PDBbind
8-mer
4gpk
RCSB PDB
PDBbind
8-mer
4gvc
RCSB PDB
PDBbind
8-mer
4gvd
RCSB PDB
PDBbind
8-mer
4gvu
RCSB PDB
PDBbind
8-mer
4h36
RCSB PDB
PDBbind
8-mer
4h75
RCSB PDB
PDBbind
8-mer
4ii9
RCSB PDB
PDBbind
8-mer
4jiz
RCSB PDB
PDBbind
8-mer
4lkl
RCSB PDB
PDBbind
8-mer
4lkm
RCSB PDB
PDBbind
8-mer
4mji
RCSB PDB
PDBbind
8-mer
4nxq
RCSB PDB
PDBbind
8-mer
4nxr
RCSB PDB
PDBbind
8-mer
4o2f
RCSB PDB
PDBbind
8-mer
4rxh
RCSB PDB
PDBbind
8-mer
4y7r
RCSB PDB
PDBbind
8-mer
4ysi
RCSB PDB
PDBbind
8-mer
5d7e
RCSB PDB
PDBbind
8-mer
5e2q
RCSB PDB
PDBbind
8-mer
5elq
RCSB PDB
PDBbind
8-mer
5em9
RCSB PDB
PDBbind
8-mer
5ema
RCSB PDB
PDBbind
8-mer
5emb
RCSB PDB
PDBbind
8-mer
5fjx
RCSB PDB
PDBbind
8-mer
5fpi
RCSB PDB
PDBbind
8-mer
5gmv
RCSB PDB
PDBbind
8-mer
5hjb
RCSB PDB
PDBbind
8-mer
5i25
RCSB PDB
PDBbind
8-mer
5iok
RCSB PDB
PDBbind
8-mer
5iql
RCSB PDB
PDBbind
8-mer
5jjm
RCSB PDB
PDBbind
8-mer
5mgx
RCSB PDB
PDBbind
8-mer
5n70
RCSB PDB
PDBbind
8-mer
5svi
RCSB PDB
PDBbind
8-mer
5sxm
RCSB PDB
PDBbind
8-mer
5t6p
RCSB PDB
PDBbind
8-mer
5t78
RCSB PDB
PDBbind
8-mer
5teg
RCSB PDB
PDBbind
8-mer
5tkj
RCSB PDB
PDBbind
8-mer
5tkk
RCSB PDB
PDBbind
8-mer
5vwi
RCSB PDB
PDBbind
8-mer
5wou
RCSB PDB
PDBbind
8-mer
5wtt
RCSB PDB
PDBbind
8-mer
5xjm
RCSB PDB
PDBbind
8-mer
5xn3
RCSB PDB
PDBbind
8-mer
5yba
RCSB PDB
PDBbind
8-mer
6cdm
RCSB PDB
PDBbind
8-mer
6cdo
RCSB PDB
PDBbind
8-mer
6cdp
RCSB PDB
PDBbind
8-mer
6e86
RCSB PDB
PDBbind
8-mer
6eww
RCSB PDB
PDBbind
8-mer
6fau
RCSB PDB
PDBbind
8-mer
6fav
RCSB PDB
PDBbind
8-mer
6faw
RCSB PDB
PDBbind
8-mer
6fbw
RCSB PDB
PDBbind
8-mer
6fby
RCSB PDB
PDBbind
8-mer
6fel
RCSB PDB
PDBbind
8-mer
6fi4
RCSB PDB
PDBbind
8-mer
6fi5
RCSB PDB
PDBbind
8-mer
6fmp
RCSB PDB
PDBbind
8-mer
6fx1
RCSB PDB
PDBbind
8-mer
6hpg
RCSB PDB
PDBbind
8-mer
6min
RCSB PDB
PDBbind
8-mer
6miq
RCSB PDB
PDBbind
8-mer
6q3q
RCSB PDB
PDBbind
8-mer
6r0x
RCSB PDB
PDBbind
8-mer
6qk8
RCSB PDB
PDBbind
8-mer
6q4q
RCSB PDB
PDBbind
8-mer
6mtv
RCSB PDB
PDBbind
8-mer
6mtu
RCSB PDB
PDBbind
8-mer
6ms1
RCSB PDB
PDBbind
8-mer
6mqe
RCSB PDB
PDBbind
8-mer
6mqc
RCSB PDB
PDBbind
8-mer
6jax
RCSB PDB
PDBbind
8-mer
6hmt
RCSB PDB
PDBbind
8-mer
6hhp
RCSB PDB
PDBbind
8-mer
6dtn
RCSB PDB
PDBbind
8-mer
6dql
RCSB PDB
PDBbind
8-mer
6do1
RCSB PDB
PDBbind
8-mer
Entry Information
PDB ID
5vwk
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Scribble PDZ1
Ligand Name
8-mer
EC.Number
E.C.-.-.-.-
Resolution
2.35(Å)
Affinity (Kd/Ki/IC50)
Kd=3.3uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Biol. Chem. Vol. 292: pp. 20425-20436
Ligand Properties
Formula
C
4
2
H
6
1
N
1
0
O
1
5
Molecular Weight
945.992
Exact Mass
945.432
No. of atoms
128
No. of bonds
130
Polar Surface Area
411.32
LOGP Value
-0.85 (
Computed with XLOGP3
)
0.58 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 11
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 32
No. of Nitrogen and Oxygen Atoms: 25
No. of Rings: 3
Canonical SMILES
OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CC(=O)O
InChI String
InChI=1S/C42H60N10O15/c1-19(2)14-30(42(66)67)51-39(63)28(16-31(43)54)50-41(65)34(21(4)53)52-37(61)26(11-12-32(55)56)47-40(64)29(17-33(57)58)49-38(62)27(15-22-18-45-24-9-6-5-8-23(22)24)48-35(59)20(3)46-36(60)25-10-7-13-44-25/h5-6,8-9,18-21,25-30,34,44-45,53H,7,10-17H2,1-4H3,(H2,43,54)(H,46,60)(H,47,64)(H,48,59)(H,49,62)(H,50,65)(H,51,63)(H,52,61)(H,55,56)(H,57,58)(H,66,67)/p+1/t20-,21+,25-,26-,27-,28-,29-,30-,34-/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):
Q14160
Entrez Gene ID
NCBI Entrez Gene ID:
23513
ASD
Information of known allosteric effects of PDB entries
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