Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2z8r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASN 579.A O no hydrogen 3.042 N/A ARG 3.A NH1 ASP 339.A OD1 no hydrogen 3.303 N/A ARG 3.A NH1 ASP 339.A OD2 no hydrogen 2.855 N/A ARG 3.A NH2 GLY 337.A O no hydrogen 2.928 N/A ARG 3.A NH2 ASP 339.A OD1 no hydrogen 2.795 N/A GLN 4.A N GLN 278.A O.A no hydrogen 2.904 N/A GLN 4.A N GLN 278.A O.B no hydrogen 2.882 N/A GLN 4.A NE2 ASP 185.A O no hydrogen 2.917 N/A MET 5.A N TYR 581.A O no hydrogen 2.783 N/A ASN 9.A N GLY 126.A O no hydrogen 3.008 N/A ARG 10.A N GLU 82.A OE1 no hydrogen 3.099 N/A ARG 10.A NH1 ARG 26.A O no hydrogen 2.849 N/A ARG 10.A NH1 GLU 31.A OE1 no hydrogen 2.916 N/A ARG 10.A NH1 GLU 31.A OE2 no hydrogen 3.276 N/A ARG 10.A NH2 GLU 31.A OE2 no hydrogen 2.798 N/A GLY 11.A N ASN 9.A OD1 no hydrogen 2.874 N/A LEU 12.A N GLU 82.A OE2 no hydrogen 3.141 N/A VAL 13.A N SER 24.A O no hydrogen 2.983 N/A VAL 15.A N PHE 22.A O no hydrogen 2.749 N/A LYS 16.A N TRP 87.A O no hydrogen 3.067 N/A THR 17.A N GLY 20.A O no hydrogen 2.859 N/A THR 17.A OG1 GLY 20.A O no hydrogen 2.667 N/A GLY 19.A N THR 17.A OG1 no hydrogen 3.233 N/A GLY 20.A N THR 17.A O no hydrogen 3.201 N/A ILE 21.A N ASP 58.A O no hydrogen 2.791 N/A PHE 22.A N VAL 15.A O no hydrogen 2.841 N/A VAL 23.A N TYR 56.A O no hydrogen 2.817 N/A SER 24.A N VAL 13.A O no hydrogen 3.025 N/A TRP 25.A N THR 54.A O no hydrogen 3.041 N/A ARG 26.A N ARG 10.A O no hydrogen 2.887 N/A ARG 26.A NH1 ASN 9.A O no hydrogen 2.986 N/A ARG 26.A NH1 GLY 126.A O no hydrogen 3.183 N/A LEU 28.A N GLU 31.A OE1 no hydrogen 2.899 N/A GLY 29.A N HIS 543.A ND1 no hydrogen 2.867 N/A GLU 31.A N LEU 28.A O no hydrogen 2.915 N/A VAL 35.A N.A ASN 32.A O no hydrogen 3.085 N/A VAL 35.A N.B ASN 32.A O no hydrogen 3.081 N/A LEU 36.A N VAL 72.A O no hydrogen 3.159 N/A PHE 37.A N VAL 51.A O no hydrogen 2.807 N/A ASN 38.A N ARG 70.A O.A no hydrogen 2.843 N/A ASN 38.A N ARG 70.A O.B no hydrogen 2.864 N/A VAL 39.A N ASN 47.A OD1 no hydrogen 2.824 N/A TYR 40.A N THR 68.A O no hydrogen 2.883 N/A TYR 40.A OH GLU 77.A OE2 no hydrogen 2.511 N/A ARG 41.A N GLN 44.A O no hydrogen 2.818 N/A ARG 41.A NH2 ASP 58.A OD2 no hydrogen 2.878 N/A ASP 42.A N THR 66.A O no hydrogen 2.807 N/A GLN 44.A N ARG 41.A O no hydrogen 3.039 N/A LEU 46.A N VAL 39.A O no hydrogen 2.780 N/A ASN 47.A ND2 PHE 37.A O no hydrogen 3.353 N/A ASN 47.A ND2 ALA 49.A O no hydrogen 2.745 N/A VAL 51.A N PHE 37.A O no hydrogen 2.771 N/A THR 53.A OG1 GLU 535.A O.B no hydrogen 3.305 N/A ASN 55.A ND2 THR 534.A O no hydrogen 3.007 N/A TYR 56.A N VAL 23.A O no hydrogen 2.817 N/A ASP 58.A N ILE 21.A O no hydrogen 2.780 N/A ASN 60.A N ASP 58.A OD1 no hydrogen 3.290 N/A GLY 61.A N ASP 58.A O no hydrogen 3.400 N/A SER 62.A N SER 65.A OG no hydrogen 2.900 N/A SER 62.A OG SER 65.A OG no hydrogen 3.361 N/A SER 65.A N SER 62.A O no hydrogen 2.908 N/A SER 65.A OG SER 62.A O no hydrogen 3.110 N/A SER 65.A OG SER 62.A OG no hydrogen 3.361 N/A THR 66.A N ASP 42.A OD2 no hydrogen 3.116 N/A THR 66.A OG1 ASP 42.A OD1 no hydrogen 2.500 N/A TYR 67.A N ALA 84.A O no hydrogen 2.804 N/A TYR 67.A OH ASP 58.A OD2 no hydrogen 2.711 N/A THR 68.A N TYR 40.A O no hydrogen 2.963 N/A VAL 69.A N SER 81.A OG no hydrogen 2.897 N/A ARG 70.A N.A ASN 38.A O no hydrogen 2.978 N/A ARG 70.A N.B ASN 38.A O no hydrogen 2.974 N/A ARG 70.A NH2.A GLU 77.A OE1 no hydrogen 3.060 N/A VAL 72.A N LEU 36.A O no hydrogen 2.710 N/A VAL 73.A N THR 76.A O no hydrogen 2.995 N/A THR 76.A N VAL 73.A O no hydrogen 3.046 N/A THR 76.A OG1 GLU 77.A O no hydrogen 3.556 N/A THR 76.A OG1 GLN 78.A OE1 no hydrogen 3.467 N/A GLN 78.A N ALA 71.A O no hydrogen 2.766 N/A SER 81.A N VAL 69.A O no hydrogen 2.820 N/A SER 81.A OG VAL 69.A O no hydrogen 3.365 N/A SER 81.A OG GLU 82.A O no hydrogen 2.834 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.772 N/A LYS 83.A NZ.B THR 66.A OG1 no hydrogen 3.399 N/A ALA 84.A N TYR 67.A O no hydrogen 2.863 N/A TRP 87.A N ALA 14.A O no hydrogen 2.803 N/A HIS 92.A N ILE 527.A O.A no hydrogen 2.963 N/A HIS 92.A N ILE 527.A O.B no hydrogen 2.813 N/A HIS 92.A NE2 LEU 158.A O no hydrogen 2.749 N/A VAL 94.A N LEU 525.A O no hydrogen 2.728 N/A LEU 96.A N SER 523.A O no hydrogen 2.881 N/A ASP 97.A N TYR 156.A OH no hydrogen 2.970 N/A LYS 98.A NZ ASP 521.A O no hydrogen 2.809 N/A GLY 102.A N TYR 110.A O no hydrogen 2.994 N/A THR 103.A OG1.B THR 104.A O no hydrogen 3.186 N/A THR 104.A N GLU 108.A O no hydrogen 2.895 N/A LYS 106.A N.A THR 104.A OG1 no hydrogen 3.219 N/A LYS 106.A N.B THR 104.A OG1 no hydrogen 3.229 N/A GLY 107.A N THR 104.A O no hydrogen 2.936 N/A GLU 108.A N THR 104.A OG1 no hydrogen 3.187 N/A TYR 110.A N GLY 102.A O no hydrogen 2.949 N/A THR 111.A N SER 137.A OG no hydrogen 2.986 N/A TYR 112.A OH ASP 150.A O no hydrogen 2.613 N/A SER 113.A N ASP 135.A O no hydrogen 3.052 N/A ALA 114.A N SER 522.A OG no hydrogen 2.914 N/A ASN 115.A N LYS 133.A O no hydrogen 2.849 N/A ASN 115.A ND2 ASN 495.A OD1 no hydrogen 2.953 N/A ALA 117.A N THR 502.A O no hydrogen 2.953 N/A SER 118.A N ILE 131.A O no hydrogen 2.844 N/A GLY 120.A N GLU 129.A O no hydrogen 3.246 N/A VAL 122.A N GLU 129.A OE1 no hydrogen 2.840 N/A GLY 124.A N ASP 121.A OD1 no hydrogen 3.046 N/A GLY 126.A N ASP 121.A OD2 no hydrogen 2.720 N/A GLN 127.A N ASP 125.A OD1 no hydrogen 3.134 N/A TYR 128.A OH GLU 6.A OE1 no hydrogen 2.661 N/A GLU 129.A N GLY 120.A O no hydrogen 2.810 N/A LEU 130.A N TYR 156.A O no hydrogen 2.920 N/A ILE 131.A N SER 118.A O no hydrogen 2.908 N/A LEU 132.A N ASP 154.A O no hydrogen 2.797 N/A LYS 133.A N ASP 116.A O no hydrogen 2.874 N/A LYS 133.A NZ ASP 116.A OD2 no hydrogen 3.033 N/A TRP 134.A N LEU 152.A O no hydrogen 2.854 N/A TRP 134.A NE1 ASP 154.A OD2 no hydrogen 2.805 N/A ASP 135.A N SER 113.A O no hydrogen 2.925 N/A SER 137.A N THR 111.A O no hydrogen 2.781 N/A SER 137.A OG THR 111.A O no hydrogen 3.455 N/A ASN 138.A ND2 GLU 108.A OE1 no hydrogen 3.013 N/A SER 139.A N PRO 136.A O no hydrogen 3.067 N/A SER 139.A OG ASP 135.A OD1 no hydrogen 3.406 N/A SER 139.A OG ASP 135.A OD2 no hydrogen 2.686 N/A SER 139.A OG PRO 136.A O no hydrogen 3.439 N/A LYS 140.A N ALA 174.A O no hydrogen 2.948 N/A LYS 140.A NZ ASN 138.A O no hydrogen 2.767 N/A ASP 141.A N GLN 144.A OE1 no hydrogen 2.930 N/A ASN 142.A ND2 ASN 263.A O no hydrogen 3.025 N/A ASN 142.A ND2 ASP 266.A O no hydrogen 2.944 N/A SER 143.A N ASP 141.A OD2 no hydrogen 2.960 N/A SER 143.A OG ASP 141.A OD2 no hydrogen 2.671 N/A GLN 144.A N ASP 141.A O no hydrogen 2.944 N/A GLY 146.A N GLN 221.A O no hydrogen 2.741 N/A THR 148.A OG1 GLY 149.A O no hydrogen 3.565 N/A GLY 149.A N ASN 138.A OD1 no hydrogen 3.048 N/A ILE 153.A N ILE 166.A O no hydrogen 2.864 N/A ASP 154.A N LEU 132.A O no hydrogen 2.836 N/A ALA 155.A N TRP 164.A O no hydrogen 3.093 N/A TYR 156.A N LEU 130.A O no hydrogen 2.852 N/A TYR 156.A OH ASP 154.A OD2 no hydrogen 2.742 N/A LYS 157.A N THR 161.A O no hydrogen 2.882 N/A LYS 157.A NZ ASP 123.A OD2 no hydrogen 2.536 N/A LYS 157.A NZ GLU 129.A OE2 no hydrogen 3.229 N/A GLY 160.A N LYS 157.A O no hydrogen 2.933 N/A THR 161.A N ASP 159.A OD1 no hydrogen 2.914 N/A THR 161.A OG1 ASP 159.A OD1 no hydrogen 2.693 N/A THR 161.A OG1 ASP 159.A OD2 no hydrogen 3.506 N/A LYS 162.A NZ ASP 97.A OD2 no hydrogen 2.732 N/A LEU 163.A N ALA 155.A O no hydrogen 2.784 N/A TRP 164.A NE1 GLY 236.A O no hydrogen 2.725 N/A ARG 165.A NE ASP 154.A OD1 no hydrogen 2.723 N/A ARG 165.A NH2 ASP 97.A O no hydrogen 2.576 N/A ARG 165.A NH2 ASP 154.A OD2 no hydrogen 2.847 N/A ILE 166.A N ILE 153.A O no hydrogen 2.754 N/A ASN 167.A N LYS 203.A O.A no hydrogen 3.061 N/A ASN 167.A N LYS 203.A O.B no hydrogen 3.039 N/A ASN 167.A ND2 ASP 150.A OD2 no hydrogen 3.127 N/A LEU 168.A N VAL 151.A O no hydrogen 2.896 N/A GLY 169.A N ASN 167.A OD1 no hydrogen 2.835 N/A ILE 172.A N GLY 169.A O no hydrogen 3.160 N/A ARG 173.A NE GLY 222.A O no hydrogen 2.995 N/A ARG 173.A NH1 ASP 141.A O no hydrogen 3.567 N/A ARG 173.A NH1 GLN 144.A O no hydrogen 3.113 N/A ARG 173.A NH1 TYR 178.A OH no hydrogen 2.897 N/A ARG 173.A NH2 GLN 144.A O no hydrogen 2.735 N/A ARG 173.A NH2 GLY 146.A O no hydrogen 2.802 N/A ALA 174.A N THR 148.A OG1 no hydrogen 2.973 N/A HIS 177.A NE2 TYR 558.A OH no hydrogen 3.284 N/A TYR 178.A N GLY 175.A O no hydrogen 3.212 N/A MET 182.A N ALA 195.A O no hydrogen 2.887 N/A TYR 184.A N GLU 193.A O no hydrogen 2.993 N/A TYR 184.A OH TYR 274.A OH no hydrogen 2.610 N/A ASP 187.A N GLU 193.A OE1 no hydrogen 3.290 N/A GLY 188.A N ASP 185.A OD1 no hydrogen 3.003 N/A ASP 189.A N ASP 185.A OD1 no hydrogen 3.307 N/A GLY 190.A N ASP 185.A OD2 no hydrogen 2.766 N/A LYS 191.A N.A ASP 189.A OD1 no hydrogen 3.066 N/A LYS 191.A N.B ASP 189.A OD1 no hydrogen 3.065 N/A ALA 192.A N ASP 121.A O no hydrogen 2.874 N/A GLU 193.A N TYR 184.A O no hydrogen 2.860 N/A VAL 194.A N PHE 234.A O no hydrogen 2.960 N/A ALA 195.A N MET 182.A O no hydrogen 2.800 N/A MET 196.A N.A THR 232.A O no hydrogen 3.140 N/A MET 196.A N.B THR 232.A O no hydrogen 3.139 N/A LYS 197.A NZ GLU 229.A OE2 no hydrogen 2.887 N/A THR 198.A N TYR 230.A O no hydrogen 2.821 N/A THR 198.A OG1 THR 232.A OG1 no hydrogen 2.754 N/A ALA 199.A N THR 202.A OG1 no hydrogen 3.058 N/A GLY 201.A N ILE 210.A O no hydrogen 2.993 N/A THR 202.A N ALA 199.A O no hydrogen 3.017 N/A THR 202.A OG1 LEU 168.A O no hydrogen 2.744 N/A THR 202.A OG1 ALA 199.A O no hydrogen 3.190 N/A LYS 203.A N.A ASN 167.A O no hydrogen 2.761 N/A LYS 203.A N.B ASN 167.A O no hydrogen 2.772 N/A ASP 204.A N LYS 208.A O.A no hydrogen 2.896 N/A ASP 204.A N LYS 208.A O.B no hydrogen 2.721 N/A GLY 205.A N GLY 239.A O no hydrogen 2.772 N/A THR 206.A N ASP 204.A OD1 no hydrogen 2.836 N/A THR 206.A OG1 ASP 204.A OD1 no hydrogen 2.676 N/A GLY 207.A N ASP 204.A O no hydrogen 2.922 N/A LYS 208.A N.A ASP 204.A OD1 no hydrogen 3.065 N/A LYS 208.A N.B ASP 204.A OD1 no hydrogen 3.066 N/A LYS 208.A NZ.A GLU 241.A OE2 no hydrogen 2.541 N/A LYS 208.A NZ.B GLU 241.A OE2 no hydrogen 2.739 N/A ILE 210.A N THR 202.A O no hydrogen 2.723 N/A ASN 212.A N.A ASP 200.A OD1 no hydrogen 2.802 N/A ASN 212.A N.B ASP 200.A OD1 no hydrogen 2.785 N/A ALA 215.A N ASN 212.A O.A no hydrogen 3.115 N/A ALA 215.A N ASN 212.A O.B no hydrogen 3.278 N/A ARG 218.A N ASP 216.A OD1 no hydrogen 3.072 N/A ARG 218.A NE ASP 216.A OD1 no hydrogen 2.962 N/A ARG 218.A NH2 ASP 216.A OD2 no hydrogen 2.898 N/A ASN 219.A N ARG 223.A O no hydrogen 2.790 N/A ASN 219.A ND2 GLN 221.A OE1 no hydrogen 2.892 N/A GLN 221.A N ASN 219.A OD1 no hydrogen 2.877 N/A GLN 221.A NE2 ASP 145.A OD1.A no hydrogen 3.099 N/A GLN 221.A NE2 ASP 145.A OD1.B no hydrogen 3.318 N/A GLN 221.A NE2 ASP 145.A OD2.A no hydrogen 3.158 N/A GLN 221.A NE2 TYR 261.A O no hydrogen 3.041 N/A GLY 222.A N ASN 219.A O no hydrogen 2.847 N/A ARG 223.A N ASN 219.A OD1 no hydrogen 3.065 N/A ARG 223.A NE ASP 145.A OD1.A no hydrogen 2.826 N/A ARG 223.A NE ASP 145.A OD1.B no hydrogen 3.085 N/A ARG 223.A NH1 ASN 142.A O no hydrogen 2.819 N/A ARG 223.A NH2 ASN 142.A O no hydrogen 2.841 N/A ARG 223.A NH2 ASP 145.A OD1.A no hydrogen 2.856 N/A ARG 223.A NH2 ASP 145.A OD1.B no hydrogen 2.841 N/A TYR 230.A N THR 198.A O no hydrogen 2.950 N/A TYR 230.A OH ASP 200.A OD1 no hydrogen 2.692 N/A LEU 231.A N ALA 245.A O no hydrogen 2.835 N/A THR 232.A N MET 196.A O.A no hydrogen 3.147 N/A THR 232.A N MET 196.A O.B no hydrogen 3.051 N/A THR 232.A OG1 THR 198.A OG1 no hydrogen 2.754 N/A THR 232.A OG1 THR 244.A OG1 no hydrogen 2.812 N/A VAL 233.A N VAL 243.A O.A no hydrogen 2.962 N/A VAL 233.A N VAL 243.A O.B no hydrogen 2.949 N/A PHE 234.A N VAL 194.A O no hydrogen 2.729 N/A GLN 235.A N LYS 240.A O.A no hydrogen 2.742 N/A GLN 235.A N LYS 240.A O.B no hydrogen 2.796 N/A THR 238.A OG1 GLN 235.A OE1 no hydrogen 2.637 N/A GLY 239.A N GLN 235.A O no hydrogen 2.730 N/A LYS 240.A N.A THR 238.A OG1 no hydrogen 3.065 N/A LYS 240.A N.B THR 238.A OG1 no hydrogen 3.071 N/A GLU 241.A N ASP 204.A OD2 no hydrogen 2.900 N/A LEU 242.A N VAL 233.A O no hydrogen 2.841 N/A VAL 243.A N.A VAL 233.A O no hydrogen 3.354 N/A VAL 243.A N.B VAL 233.A O no hydrogen 3.366 N/A THR 244.A OG1 THR 232.A OG1 no hydrogen 2.812 N/A THR 244.A OG1 GLU 241.A OE1 no hydrogen 2.556 N/A ALA 245.A N LEU 231.A O no hydrogen 2.917 N/A PHE 247.A N GLU 229.A O no hydrogen 2.730 N/A GLU 248.A N.A TYR 297.A OH no hydrogen 3.062 N/A GLU 248.A N.B TYR 297.A OH no hydrogen 3.067 N/A ALA 250.A N GLU 248.A OE1.A no hydrogen 2.897 N/A ARG 251.A NH1 GLY 227.A O no hydrogen 2.897 N/A ASN 253.A N ASP 256.A OD2 no hydrogen 2.967 N/A ASN 253.A ND2 ASP 256.A OD1 no hydrogen 3.228 N/A ASP 256.A N ASN 253.A O no hydrogen 2.933 N/A TRP 257.A N VAL 254.A O no hydrogen 3.185 N/A TRP 257.A NE1 ARG 251.A O no hydrogen 2.784 N/A GLY 258.A N SER 255.A O no hydrogen 3.309 N/A GLY 262.A N ASP 259.A OD1 no hydrogen 2.953 N/A ASN 263.A N ASP 259.A OD1 no hydrogen 3.001 N/A ASN 263.A ND2 TYR 261.A OH no hydrogen 2.912 N/A ARG 264.A N ASP 259.A OD2 no hydrogen 2.826 N/A ARG 264.A NH1 ASP 259.A OD2 no hydrogen 2.939 N/A ASP 266.A N ASN 263.A O no hydrogen 3.156 N/A ARG 267.A N ARG 264.A O no hydrogen 3.370 N/A ARG 267.A NE ASN 263.A OD1 no hydrogen 2.949 N/A ARG 267.A NH1 TYR 288.A OH no hydrogen 3.558 N/A ARG 267.A NH2 ASN 263.A OD1 no hydrogen 3.010 N/A PHE 268.A N HIS 177.A O no hydrogen 3.171 N/A LEU 269.A N THR 285.A O no hydrogen 3.414 N/A GLY 271.A N ILE 283.A O.A no hydrogen 2.883 N/A GLY 271.A N ILE 283.A O.B no hydrogen 3.057 N/A ALA 273.A N SER 281.A O no hydrogen 2.943 N/A TYR 274.A N ASP 339.A OD2 no hydrogen 2.749 N/A TYR 274.A OH GLN 4.A O no hydrogen 2.597 N/A TYR 274.A OH TYR 184.A OH no hydrogen 2.610 N/A GLY 277.A N TYR 274.A O no hydrogen 3.061 N/A GLN 278.A N.A ASP 276.A OD1 no hydrogen 2.882 N/A GLN 278.A N.B ASP 276.A OD1 no hydrogen 2.890 N/A ARG 279.A N ASP 276.A OD1 no hydrogen 2.814 N/A ARG 279.A NH2 ASP 187.A O no hydrogen 2.992 N/A SER 281.A N ALA 273.A O no hydrogen 2.733 N/A LEU 282.A N TYR 297.A O no hydrogen 2.778 N/A ILE 283.A N.A GLY 271.A O no hydrogen 2.805 N/A ILE 283.A N.B GLY 271.A O no hydrogen 2.791 N/A MET 284.A N.A VAL 295.A O.A no hydrogen 2.905 N/A MET 284.A N.A VAL 295.A O.B no hydrogen 2.945 N/A MET 284.A N.B VAL 295.A O.A no hydrogen 2.892 N/A MET 284.A N.B VAL 295.A O.B no hydrogen 2.928 N/A THR 285.A N LEU 269.A O no hydrogen 2.956 N/A ARG 286.A N MET 293.A O no hydrogen 2.888 N/A ARG 286.A NE VAL 265.A O no hydrogen 2.736 N/A ARG 286.A NH1 GLU 229.A OE1 no hydrogen 2.874 N/A ARG 286.A NH1 GLU 229.A OE2 no hydrogen 3.272 N/A ARG 286.A NH1 PRO 249.A O no hydrogen 2.895 N/A ARG 286.A NH2 GLU 229.A OE2 no hydrogen 2.880 N/A ARG 286.A NH2 ASP 266.A OD1 no hydrogen 3.140 N/A GLY 287.A N ARG 267.A O no hydrogen 2.762 N/A TYR 288.A OH HIS 326.A ND1 no hydrogen 2.879 N/A THR 292.A N SER 312.A OG no hydrogen 2.865 N/A THR 292.A OG1 ALA 290.A O no hydrogen 2.914 N/A MET 293.A N ARG 286.A O no hydrogen 2.828 N/A LEU 294.A N LEU 310.A O no hydrogen 2.878 N/A VAL 295.A N.A MET 284.A O.A no hydrogen 2.918 N/A VAL 295.A N.A MET 284.A O.B no hydrogen 2.812 N/A VAL 295.A N.B MET 284.A O.A no hydrogen 2.915 N/A VAL 295.A N.B MET 284.A O.B no hydrogen 2.808 N/A ALA 296.A N TRP 308.A O no hydrogen 3.089 N/A TYR 297.A N LEU 282.A O no hydrogen 2.755 N/A TYR 297.A OH GLU 248.A O.A no hydrogen 2.848 N/A TYR 297.A OH GLU 248.A O.B no hydrogen 2.806 N/A ASN 298.A N SER 305.A O.A no hydrogen 2.851 N/A ASN 298.A N SER 305.A O.B no hydrogen 2.881 N/A ASN 298.A ND2 SER 281.A OG no hydrogen 2.724 N/A ASN 298.A ND2 TYR 297.A O no hydrogen 3.347 N/A ARG 300.A N LYS 303.A O.A no hydrogen 3.061 N/A ARG 300.A N LYS 303.A O.B no hydrogen 3.098 N/A ARG 300.A NH1 ASP 276.A OD2 no hydrogen 2.948 N/A ARG 300.A NH2 ASP 276.A OD2 no hydrogen 3.242 N/A ARG 300.A NH2 PRO 280.A O no hydrogen 3.032 N/A LYS 303.A N.A ARG 300.A O no hydrogen 2.978 N/A LYS 303.A N.B ARG 300.A O no hydrogen 2.995 N/A LYS 303.A NZ.A ASP 301.A O no hydrogen 3.106 N/A SER 305.A N.A ASN 298.A O no hydrogen 2.889 N/A SER 305.A N.B ASN 298.A O no hydrogen 2.882 N/A LYS 306.A NZ GLU 248.A OE1.B no hydrogen 2.717 N/A LYS 306.A NZ GLU 248.A OE2.B no hydrogen 3.174 N/A LEU 307.A N ALA 296.A O no hydrogen 2.717 N/A TRP 308.A NE1 HIS 350.A O no hydrogen 2.996 N/A LEU 310.A N LEU 294.A O no hydrogen 2.824 N/A SER 312.A N THR 292.A O no hydrogen 2.967 N/A SER 312.A OG THR 292.A O no hydrogen 3.326 N/A SER 313.A N ASP 311.A OD1 no hydrogen 2.936 N/A SER 313.A OG ASP 311.A OD1 no hydrogen 2.710 N/A SER 313.A OG ASP 311.A OD2 no hydrogen 3.248 N/A LYS 314.A N.A ASP 311.A O no hydrogen 3.085 N/A LYS 314.A N.B ASP 311.A O no hydrogen 3.095 N/A GLY 316.A N GLU 318.A OE1 no hydrogen 3.038 N/A GLY 316.A N GLU 318.A OE2 no hydrogen 3.322 N/A ASN 317.A N LYS 314.A O.A no hydrogen 2.871 N/A ASN 317.A N LYS 314.A O.B no hydrogen 2.900 N/A ASN 317.A ND2 ASP 311.A O no hydrogen 3.228 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.794 N/A PHE 320.A N ASN 317.A O no hydrogen 2.939 N/A ALA 321.A N GLU 318.A O no hydrogen 3.347 N/A GLY 322.A N ALA 290.A O no hydrogen 3.059 N/A GLN 323.A NE2 ALA 321.A O no hydrogen 3.083 N/A ASN 325.A ND2 ALA 365.A O no hydrogen 2.968 N/A HIS 326.A N GLY 363.A O no hydrogen 3.360 N/A HIS 326.A ND1 TYR 288.A OH no hydrogen 2.879 N/A SER 329.A N ILE 342.A O no hydrogen 2.856 N/A SER 329.A OG THR 368.A OG1 no hydrogen 2.997 N/A ALA 331.A N GLU 340.A O no hydrogen 3.076 N/A VAL 333.A N GLU 340.A OE1 no hydrogen 2.875 N/A GLY 335.A N ASP 332.A OD1 no hydrogen 2.925 N/A ASP 336.A N ASP 334.A OD1 no hydrogen 3.279 N/A GLY 337.A N ASP 332.A OD2 no hydrogen 2.896 N/A LYS 338.A N ASP 336.A OD1 no hydrogen 2.906 N/A ASP 339.A N TYR 274.A O no hydrogen 2.922 N/A GLU 340.A N ALA 331.A O no hydrogen 2.804 N/A ILE 341.A N VAL 348.A O no hydrogen 2.869 N/A ILE 342.A N SER 329.A O no hydrogen 2.795 N/A PHE 343.A N MET 346.A O no hydrogen 2.811 N/A SER 345.A N GLN 323.A O no hydrogen 2.851 N/A SER 345.A OG GLY 361.A O no hydrogen 2.757 N/A MET 346.A N PHE 343.A O no hydrogen 3.100 N/A ALA 347.A N TYR 356.A O no hydrogen 3.102 N/A VAL 348.A N ILE 341.A O no hydrogen 2.862 N/A ASP 349.A N LYS 353.A O no hydrogen 2.770 N/A HIS 350.A N ASP 349.A OD1 no hydrogen 2.868 N/A GLY 352.A N ASP 349.A O no hydrogen 2.920 N/A LYS 353.A N ASP 351.A OD1 no hydrogen 3.137 N/A MET 355.A N.A ALA 347.A O no hydrogen 2.824 N/A MET 355.A N.B ALA 347.A O no hydrogen 2.834 N/A TYR 356.A OH ALA 398.A O no hydrogen 2.680 N/A SER 357.A OG ALA 319.A O no hydrogen 3.501 N/A THR 358.A N SER 345.A O no hydrogen 2.846 N/A THR 358.A OG1 SER 345.A O no hydrogen 3.429 N/A GLY 359.A N SER 357.A OG no hydrogen 3.038 N/A LEU 360.A N THR 358.A OG1 no hydrogen 3.271 N/A GLY 361.A N GLN 323.A OE1 no hydrogen 2.958 N/A HIS 362.A ND1 GLY 324.A O no hydrogen 2.794 N/A GLY 363.A N ASN 325.A OD1 no hydrogen 2.878 N/A HIS 367.A N PHE 381.A O no hydrogen 2.880 N/A HIS 367.A ND1 HIS 563.A NE2 no hydrogen 2.919 N/A HIS 367.A NE2 GLY 416.A O no hydrogen 2.836 N/A THR 368.A OG1 SER 329.A OG no hydrogen 2.997 N/A GLY 369.A N GLU 379.A O no hydrogen 3.195 N/A ASP 372.A N GLU 379.A OE1 no hydrogen 2.891 N/A GLY 374.A N ASP 372.A OD2 no hydrogen 2.977 N/A ARG 375.A N ASP 372.A O no hydrogen 3.107 N/A ARG 375.A NE GLU 379.A OE2 no hydrogen 2.710 N/A ARG 375.A NH1 ASP 397.A OD2 no hydrogen 2.783 N/A ARG 375.A NH2 LEU 378.A O no hydrogen 2.953 N/A ARG 375.A NH2 GLU 379.A OE2 no hydrogen 3.234 N/A GLU 379.A N GLY 369.A O no hydrogen 2.909 N/A VAL 380.A N ARG 396.A O no hydrogen 2.970 N/A PHE 381.A N HIS 367.A O no hydrogen 2.860 N/A GLN 382.A N SER 394.A O no hydrogen 2.949 N/A GLN 382.A NE2 ASN 325.A OD1 no hydrogen 2.924 N/A GLN 382.A NE2 SER 345.A OG no hydrogen 2.998 N/A VAL 383.A N ALA 365.A O no hydrogen 3.488 N/A HIS 384.A N GLY 392.A O no hydrogen 2.960 N/A HIS 384.A NE2 SER 394.A OG no hydrogen 2.729 N/A GLU 385.A N HIS 362.A O no hydrogen 2.940 N/A LYS 387.A NZ GLY 410.A O no hydrogen 3.183 N/A ASN 388.A N ASP 386.A OD1.A no hydrogen 2.776 N/A ASN 388.A N ASP 386.A OD1.B no hydrogen 3.115 N/A ALA 389.A N ASP 386.A O.A no hydrogen 3.029 N/A ALA 389.A N ASP 386.A O.B no hydrogen 3.064 N/A GLY 392.A N VAL 407.A O no hydrogen 2.821 N/A LEU 393.A N VAL 407.A O no hydrogen 3.363 N/A SER 394.A N GLN 382.A O no hydrogen 2.847 N/A SER 394.A OG HIS 384.A NE2 no hydrogen 2.729 N/A PHE 395.A N TRP 405.A O no hydrogen 2.911 N/A ARG 396.A N VAL 380.A O no hydrogen 2.945 N/A ARG 396.A NE TYR 356.A OH no hydrogen 2.960 N/A ARG 396.A NH1 GLY 344.A O no hydrogen 3.061 N/A ARG 396.A NH1 GLN 382.A OE1 no hydrogen 2.855 N/A ARG 396.A NH2 GLY 344.A O no hydrogen 2.855 N/A ARG 396.A NH2 TYR 356.A OH no hydrogen 3.179 N/A ASP 397.A N LYS 402.A O.A no hydrogen 2.892 N/A ASP 397.A N LYS 402.A O.B no hydrogen 2.878 N/A ALA 398.A N LEU 378.A O no hydrogen 3.031 N/A ALA 399.A N ASP 397.A OD1 no hydrogen 2.873 N/A THR 400.A N ASP 397.A OD1 no hydrogen 3.022 N/A GLY 401.A N ASP 397.A O no hydrogen 2.876 N/A LYS 402.A N.A THR 400.A OG1 no hydrogen 3.153 N/A LYS 402.A N.B THR 400.A OG1 no hydrogen 3.144 N/A LYS 402.A NZ.B ILE 403.A O no hydrogen 2.647 N/A LEU 404.A N PHE 395.A O no hydrogen 2.805 N/A TRP 405.A N PHE 395.A O no hydrogen 3.210 N/A TRP 405.A NE1 ALA 439.A O no hydrogen 2.975 N/A VAL 407.A N LEU 393.A O no hydrogen 3.061 N/A VAL 413.A N.A HIS 384.A O no hydrogen 3.039 N/A VAL 413.A N.B HIS 384.A O no hydrogen 3.051 N/A ARG 415.A NH1 THR 452.A O no hydrogen 3.155 N/A ARG 415.A NH2 THR 497.A O no hydrogen 2.867 N/A MET 417.A N TRP 431.A O no hydrogen 2.920 N/A ALA 419.A N GLU 429.A O no hydrogen 2.881 N/A ILE 421.A N GLU 429.A OE1 no hydrogen 2.864 N/A ASP 422.A N GLU 429.A OE1 no hydrogen 2.851 N/A ARG 424.A N ASP 422.A OD1 no hydrogen 2.932 N/A ARG 424.A NE ASP 422.A OD1 no hydrogen 2.972 N/A ARG 424.A NE ASP 422.A OD2 no hydrogen 3.436 N/A ARG 424.A NH2 ASP 422.A OD2 no hydrogen 2.793 N/A TYR 425.A N ASP 422.A O no hydrogen 3.410 N/A GLN 428.A N LEU 371.A O no hydrogen 2.839 N/A GLN 428.A NE2 ASP 370.A O no hydrogen 3.296 N/A GLU 429.A N ALA 419.A O no hydrogen 2.937 N/A VAL 430.A N TYR 437.A O no hydrogen 2.940 N/A TRP 431.A N MET 417.A O no hydrogen 2.973 N/A TRP 431.A NE1 SER 451.A O no hydrogen 2.873 N/A ALA 432.A N SER 435.A O no hydrogen 3.131 N/A SER 435.A N ALA 432.A O no hydrogen 3.202 N/A TYR 437.A N VAL 430.A O no hydrogen 2.762 N/A SER 438.A N VAL 442.A O no hydrogen 2.881 N/A LYS 440.A N SER 438.A OG no hydrogen 3.095 N/A LYS 440.A NZ ASP 372.A OD1 no hydrogen 2.712 N/A LYS 440.A NZ ASP 372.A OD2 no hydrogen 3.509 N/A GLY 441.A N SER 438.A O no hydrogen 2.900 N/A VAL 442.A N SER 438.A OG no hydrogen 3.255 N/A LYS 443.A NZ SER 435.A OG no hydrogen 2.939 N/A ILE 444.A N LEU 436.A O no hydrogen 2.787 N/A SER 450.A N SER 482.A OG no hydrogen 2.900 N/A SER 450.A OG ASP 473.A OD2 no hydrogen 3.450 N/A ASN 453.A ND2 ASP 468.A OD1 no hydrogen 2.841 N/A ASN 453.A ND2 ALA 499.A O no hydrogen 3.042 N/A PHE 454.A N LEU 467.A O no hydrogen 3.104 N/A ILE 456.A N GLU 465.A O no hydrogen 2.784 N/A TRP 457.A N GLU 513.A OE1 no hydrogen 2.812 N/A TRP 458.A N GLU 465.A OE1 no hydrogen 2.916 N/A ASP 459.A N GLU 465.A OE1 no hydrogen 3.008 N/A ASP 461.A N ASP 459.A OD1 no hydrogen 2.969 N/A ARG 464.A N ASP 420.A O no hydrogen 2.820 N/A ARG 464.A NH1 PRO 562.A O no hydrogen 2.832 N/A ARG 464.A NH2 GLU 513.A OE1 no hydrogen 2.938 N/A ARG 464.A NH2 GLU 513.A OE2 no hydrogen 3.367 N/A ARG 464.A NH2 PRO 562.A O no hydrogen 2.858 N/A GLU 465.A N ILE 456.A O no hydrogen 2.753 N/A GLN 466.A N ASP 473.A O no hydrogen 2.897 N/A GLN 466.A NE2 ARG 464.A O no hydrogen 3.116 N/A LEU 467.A N PHE 454.A O no hydrogen 2.938 N/A ASP 468.A N ARG 471.A O no hydrogen 3.037 N/A SER 469.A N.A ALA 499.A O no hydrogen 3.153 N/A SER 469.A N.B ALA 499.A O no hydrogen 3.143 N/A SER 469.A OG.A ASN 470.A OD1 no hydrogen 3.440 N/A ASN 470.A ND2 ALA 488.A O no hydrogen 2.998 N/A ASN 470.A ND2 ALA 491.A O no hydrogen 3.377 N/A ARG 471.A N ASP 468.A O no hydrogen 2.891 N/A ILE 472.A N LEU 486.A O no hydrogen 2.928 N/A ASP 473.A N GLN 466.A O no hydrogen 2.797 N/A LYS 474.A N.A LYS 483.A O.A no hydrogen 2.814 N/A LYS 474.A N.A LYS 483.A O.B no hydrogen 2.764 N/A LYS 474.A N.B LYS 483.A O.A no hydrogen 2.782 N/A LYS 474.A N.B LYS 483.A O.B no hydrogen 2.729 N/A LYS 474.A NZ.A ASP 459.A OD2 no hydrogen 2.726 N/A LYS 474.A NZ.A ASP 461.A OD1 no hydrogen 3.230 N/A LYS 474.A NZ.A ASP 461.A OD2 no hydrogen 2.708 N/A LYS 474.A NZ.A GLU 465.A OE2 no hydrogen 2.882 N/A LYS 474.A NZ.B ASP 459.A OD2 no hydrogen 3.025 N/A LYS 474.A NZ.B ASP 461.A OD2 no hydrogen 2.724 N/A LYS 474.A NZ.B GLU 465.A OE2 no hydrogen 2.818 N/A ASP 476.A N VAL 481.A O no hydrogen 2.798 N/A ASN 479.A N ASP 476.A OD1 no hydrogen 3.127 N/A ASN 479.A ND2 ASP 476.A OD2 no hydrogen 2.655 N/A VAL 481.A N ASP 476.A O no hydrogen 3.287 N/A LYS 483.A N.A LYS 474.A O.A no hydrogen 2.982 N/A LYS 483.A N.A LYS 474.A O.B no hydrogen 2.753 N/A LYS 483.A N.B LYS 474.A O.A no hydrogen 2.974 N/A LYS 483.A N.B LYS 474.A O.B no hydrogen 2.747 N/A MET 485.A N.A ILE 472.A O no hydrogen 2.739 N/A MET 485.A N.B ILE 472.A O no hydrogen 2.755 N/A LEU 486.A N ILE 472.A O no hydrogen 2.987 N/A ALA 488.A N ASN 470.A O no hydrogen 2.871 N/A SER 489.A N.A THR 487.A O no hydrogen 3.035 N/A SER 489.A N.B THR 487.A O no hydrogen 3.041 N/A ALA 491.A N ALA 488.A O no hydrogen 2.982 N/A ALA 492.A N ARG 518.A O no hydrogen 2.919 N/A ASN 494.A N THR 500.A O no hydrogen 2.746 N/A ASN 495.A ND2 ASP 116.A OD1 no hydrogen 3.079 N/A ASN 495.A ND2 THR 500.A OG1 no hydrogen 2.980 N/A LYS 498.A N ASN 495.A O no hydrogen 3.064 N/A LYS 498.A NZ ASP 364.A OD2 no hydrogen 3.520 N/A ALA 499.A N GLY 496.A O no hydrogen 2.949 N/A THR 500.A N ASN 494.A O no hydrogen 2.988 N/A THR 502.A OG1 ASN 115.A O no hydrogen 2.797 N/A THR 502.A OG1 ASN 494.A OD1 no hydrogen 2.938 N/A LEU 503.A N VAL 516.A O no hydrogen 3.113 N/A ALA 505.A N GLU 514.A O no hydrogen 2.991 N/A ASP 506.A N TYR 547.A OH no hydrogen 3.000 N/A LEU 507.A N.A GLU 514.A OE1 no hydrogen 2.829 N/A LEU 507.A N.B ALA 505.A O no hydrogen 2.948 N/A LEU 507.A N.B GLU 514.A OE1 no hydrogen 2.866 N/A LEU 508.A N.A GLU 514.A OE1 no hydrogen 3.250 N/A LEU 508.A N.B GLU 514.A OE1 no hydrogen 3.033 N/A GLY 509.A N GLY 11.A O no hydrogen 2.701 N/A ASP 510.A N SER 24.A OG no hydrogen 3.041 N/A TRP 511.A NE1 HIS 536.A O no hydrogen 2.937 N/A ARG 512.A N ASP 510.A OD1 no hydrogen 3.202 N/A ARG 512.A NE ASP 510.A OD1 no hydrogen 2.895 N/A ARG 512.A NE ASP 510.A OD2 no hydrogen 3.247 N/A ARG 512.A NH1 ASP 459.A O no hydrogen 3.045 N/A ARG 512.A NH1 ILE 532.A O no hydrogen 2.808 N/A ARG 512.A NH2 ASP 510.A OD2 no hydrogen 2.877 N/A ARG 512.A NH2 ILE 532.A O no hydrogen 2.854 N/A GLU 513.A N TRP 457.A O no hydrogen 2.845 N/A GLU 514.A N ALA 505.A O no hydrogen 2.849 N/A VAL 515.A N TYR 528.A O no hydrogen 3.087 N/A VAL 516.A N LEU 503.A O no hydrogen 2.732 N/A TRP 517.A N ARG 526.A O no hydrogen 3.012 N/A TRP 517.A NE1 SER 469.A O.A no hydrogen 2.904 N/A TRP 517.A NE1 SER 469.A O.B no hydrogen 2.907 N/A ARG 518.A NH2 ALA 493.A O no hydrogen 2.977 N/A THR 519.A N ALA 524.A O no hydrogen 2.915 N/A THR 519.A OG1 ASP 521.A OD1 no hydrogen 2.891 N/A THR 519.A OG1 SER 523.A OG no hydrogen 3.416 N/A THR 519.A OG1 ALA 524.A O no hydrogen 3.444 N/A GLU 520.A N.A GLY 490.A O no hydrogen 3.344 N/A GLU 520.A N.B GLY 490.A O no hydrogen 3.334 N/A SER 522.A N THR 519.A O no hydrogen 2.948 N/A SER 523.A N THR 519.A OG1 no hydrogen 3.202 N/A SER 523.A N ASP 521.A OD1 no hydrogen 3.002 N/A SER 523.A OG THR 519.A OG1 no hydrogen 3.416 N/A SER 523.A OG ASP 521.A OD1 no hydrogen 2.741 N/A ALA 524.A N THR 519.A OG1 no hydrogen 3.345 N/A LEU 525.A N VAL 94.A O no hydrogen 2.934 N/A ARG 526.A N TRP 517.A O no hydrogen 2.740 N/A ARG 526.A NH1 SER 489.A O.A no hydrogen 2.800 N/A ARG 526.A NH1 SER 489.A O.B no hydrogen 2.900 N/A ARG 526.A NH1 TYR 528.A OH no hydrogen 3.200 N/A ILE 527.A N.A HIS 92.A O no hydrogen 2.789 N/A ILE 527.A N.B HIS 92.A O no hydrogen 2.775 N/A TYR 528.A N VAL 515.A O no hydrogen 2.757 N/A THR 529.A OG1 GLU 514.A OE2 no hydrogen 2.689 N/A THR 530.A OG1 TRP 458.A O no hydrogen 2.826 N/A ILE 532.A N THR 530.A OG1 no hydrogen 3.210 N/A THR 534.A N ASN 55.A OD1 no hydrogen 2.941 N/A THR 534.A OG1 GLY 460.A O no hydrogen 2.782 N/A HIS 536.A N THR 534.A OG1 no hydrogen 3.098 N/A ARG 537.A NH1 VAL 35.A O.A no hydrogen 2.685 N/A ARG 537.A NH1 VAL 35.A O.B no hydrogen 2.909 N/A ARG 537.A NH1 LYS 52.A O no hydrogen 3.004 N/A ARG 537.A NH2 VAL 35.A O.A no hydrogen 3.114 N/A ARG 537.A NH2 VAL 35.A O.B no hydrogen 3.134 N/A TYR 539.A OH GLU 31.A O no hydrogen 2.666 N/A THR 540.A N PHE 27.A O no hydrogen 2.882 N/A THR 540.A OG1 ASP 506.A OD2 no hydrogen 3.113 N/A LEU 541.A N ASP 506.A OD2 no hydrogen 3.031 N/A HIS 543.A N THR 540.A O no hydrogen 2.904 N/A HIS 543.A NE2 GLU 6.A O no hydrogen 2.847 N/A ASP 544.A N LEU 541.A O no hydrogen 3.013 N/A VAL 546.A N ASP 544.A OD2 no hydrogen 3.121 N/A TYR 547.A N ASP 544.A OD2 no hydrogen 2.963 N/A TYR 547.A OH GLU 513.A OE2 no hydrogen 2.611 N/A ARG 548.A N ASP 544.A O no hydrogen 3.013 N/A ARG 548.A NE GLU 6.A OE1 no hydrogen 2.911 N/A ARG 548.A NE GLU 6.A OE2 no hydrogen 3.436 N/A ARG 548.A NH1 ARG 548.A O no hydrogen 2.925 N/A ARG 548.A NH2 GLU 6.A OE2 no hydrogen 2.872 N/A ARG 548.A NH2 VAL 119.A O no hydrogen 3.401 N/A LEU 549.A N PRO 545.A O.A no hydrogen 3.243 N/A GLY 550.A N VAL 546.A O no hydrogen 2.950 N/A ILE 551.A N TYR 547.A O no hydrogen 2.981 N/A ALA 552.A N ARG 548.A O no hydrogen 3.248 N/A TRP 553.A N LEU 549.A O no hydrogen 3.064 N/A GLN 554.A N ILE 551.A O no hydrogen 3.252 N/A ILE 556.A N TRP 553.A O no hydrogen 2.942 N/A TYR 558.A N HIS 326.A O no hydrogen 2.965 N/A ASN 559.A ND2 ASP 116.A OD1 no hydrogen 2.940 N/A GLN 560.A NE2 LEU 366.A O no hydrogen 3.583 N/A HIS 563.A NE2 HIS 367.A ND1 no hydrogen 2.919 N/A THR 564.A OG1 PHE 566.A O no hydrogen 2.740 N/A SER 565.A N ASP 544.A OD2 no hydrogen 2.789 N/A SER 565.A OG ASP 544.A OD1 no hydrogen 2.631 N/A SER 565.A OG ASP 544.A OD2 no hydrogen 3.568 N/A ASP 570.A N ASP 420.A OD2 no hydrogen 2.856 N/A MET 572.A N GLY 569.A O no hydrogen 3.133 N/A GLN 575.A NE2 ALA 573.A O no hydrogen 2.941 N/A LYS 577.A NZ.A GLY 29.A O no hydrogen 3.448 N/A TYR 581.A N ARG 3.A O no hydrogen 2.944 N/A TYR 581.A OH GLN 278.A OE1.B no hydrogen 3.186 N/A