Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ha3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N ALA 3.A O no hydrogen 3.370 N/A PHE 11.A N SER 8.A O no hydrogen 2.840 N/A ALA 13.A N ASP 9.A O no hydrogen 3.069 N/A LEU 14.A N PHE 11.A O no hydrogen 2.821 N/A PHE 15.A N PHE 12.A O no hydrogen 3.120 N/A GLN 16.A N PHE 12.A O no hydrogen 3.025 N/A THR 19.A N ASP 17.A OD1 no hydrogen 2.993 N/A THR 19.A OG1 ASP 17.A OD1 no hydrogen 2.625 N/A THR 19.A OG1 ASP 17.A OD2 no hydrogen 3.150 N/A THR 19.A OG1 THR 21.A OG1 no hydrogen 2.674 N/A ARG 20.A N ASP 17.A O no hydrogen 2.960 N/A THR 21.A OG1 THR 19.A OG1 no hydrogen 2.674 N/A CYS 24.A N GLU 126.A OE1 no hydrogen 2.826 N/A CYS 24.A SG ALA 25.A O no hydrogen 3.391 N/A CYS 24.A SG LEU 217.A O no hydrogen 3.903 N/A ALA 25.A N THR 224.A OG1 no hydrogen 3.101 N/A TYR 26.A N ALA 37.A O no hydrogen 2.901 N/A PHE 27.A N HIS 220.A ND1 no hydrogen 3.028 N/A GLU 28.A N TYR 26.A O no hydrogen 2.986 N/A LEU 32.A N PRO 29.A O no hydrogen 3.100 N/A THR 33.A N GLU 36.A OE1 no hydrogen 2.908 N/A GLU 36.A N THR 33.A OG1 no hydrogen 3.097 N/A ALA 37.A N THR 33.A O no hydrogen 2.735 N/A GLN 38.A N LEU 34.A O no hydrogen 2.786 N/A GLN 38.A N GLU 35.A O no hydrogen 3.159 N/A GLN 38.A NE2 SER 23.A O no hydrogen 2.887 N/A TYR 39.A N GLU 35.A O no hydrogen 3.290 N/A ALA 40.A N GLU 36.A O no hydrogen 3.024 N/A LYS 41.A N ALA 37.A O no hydrogen 2.979 N/A LYS 41.A NZ SER 23.A OG no hydrogen 2.650 N/A LYS 41.A NZ CYS 24.A O no hydrogen 2.667 N/A LYS 41.A NZ GLN 38.A OE1 no hydrogen 2.755 N/A VAL 42.A N GLN 38.A O no hydrogen 3.009 N/A ASP 43.A N TYR 39.A O no hydrogen 2.893 N/A LEU 44.A N ALA 40.A O no hydrogen 2.792 N/A ASN 45.A N LYS 41.A O no hydrogen 3.098 N/A ASN 45.A N VAL 42.A O no hydrogen 3.183 N/A ASN 45.A ND2 LYS 41.A O no hydrogen 2.864 N/A ASN 45.A ND2 GLN 156.A OE1 no hydrogen 3.057 N/A LEU 46.A N VAL 42.A O no hydrogen 2.965 N/A ASP 47.A N ASP 43.A O no hydrogen 2.786 N/A LYS 48.A N ASN 45.A O no hydrogen 3.177 N/A LEU 49.A N LEU 46.A O no hydrogen 2.953 N/A GLY 54.A N ASP 76.A O no hydrogen 2.850 N/A MET 55.A N LYS 52.A O no hydrogen 3.139 N/A THR 56.A N ASP 120.A OD1 no hydrogen 2.755 N/A LEU 57.A N ASN 78.A O no hydrogen 2.770 N/A LEU 58.A N ARG 121.A O no hydrogen 2.931 N/A ASP 59.A N ILE 80.A O no hydrogen 2.849 N/A ILE 60.A N VAL 123.A O no hydrogen 2.943 N/A GLY 61.A N LEU 82.A O no hydrogen 2.865 N/A CYS 62.A N LEU 82.A O no hydrogen 2.924 N/A CYS 62.A SG LEU 82.A O no hydrogen 3.644 N/A GLY 65.A N CYS 62.A O no hydrogen 3.067 N/A THR 66.A OG1 THR 19.A O no hydrogen 3.456 N/A ARG 69.A N GLY 65.A O no hydrogen 3.132 N/A ARG 69.A NE GLU 73.A OE2 no hydrogen 2.704 N/A ARG 70.A N THR 66.A O no hydrogen 3.008 N/A ARG 70.A NH1 ASP 43.A OD2 no hydrogen 3.165 N/A ALA 71.A N THR 67.A O no hydrogen 2.949 N/A VAL 72.A N MET 68.A O no hydrogen 2.805 N/A GLU 73.A N ARG 69.A O no hydrogen 2.889 N/A ARG 74.A N ARG 70.A O no hydrogen 2.892 N/A ARG 74.A NH1 ASP 47.A OD1 no hydrogen 2.724 N/A ARG 74.A NH2 ASP 47.A OD1 no hydrogen 2.864 N/A PHE 75.A N ALA 71.A O no hydrogen 2.913 N/A ASP 76.A N VAL 72.A O no hydrogen 2.823 N/A ASN 78.A N MET 55.A O no hydrogen 2.927 N/A ASN 78.A ND2 MET 55.A O no hydrogen 3.444 N/A VAL 79.A N SER 104.A O no hydrogen 3.076 N/A ILE 80.A N LEU 57.A O no hydrogen 2.981 N/A GLY 81.A N GLN 106.A O no hydrogen 3.060 N/A LEU 82.A N ASP 59.A O no hydrogen 2.957 N/A THR 83.A N LEU 108.A O no hydrogen 3.104 N/A SER 85.A N THR 83.A OG1 no hydrogen 3.285 N/A ASN 87.A ND2 ASP 9.A OD2 no hydrogen 2.762 N/A GLN 88.A N SER 85.A OG no hydrogen 3.120 N/A HIS 89.A N SER 85.A O no hydrogen 3.056 N/A HIS 89.A N LYS 86.A O no hydrogen 3.177 N/A ALA 90.A N LYS 86.A O no hydrogen 3.175 N/A ARG 91.A N ASN 87.A O no hydrogen 2.928 N/A CYS 92.A N GLN 88.A O no hydrogen 2.878 N/A CYS 92.A SG GLY 63.A O no hydrogen 2.919 N/A CYS 92.A SG GLN 88.A O no hydrogen 2.857 N/A GLU 93.A N HIS 89.A O no hydrogen 2.987 N/A GLN 94.A N ALA 90.A O no hydrogen 3.098 N/A VAL 95.A N ARG 91.A O no hydrogen 2.882 N/A LEU 96.A N CYS 92.A O no hydrogen 2.859 N/A ALA 97.A N GLU 93.A O no hydrogen 2.780 N/A SER 98.A N GLN 94.A O no hydrogen 3.230 N/A SER 98.A OG GLN 94.A O no hydrogen 2.761 N/A ILE 99.A N LEU 96.A O no hydrogen 3.174 N/A ARG 103.A N THR 101.A OG1 no hydrogen 3.195 N/A ARG 103.A NE ASP 76.A O no hydrogen 3.163 N/A ARG 103.A NE ASP 76.A OD1 no hydrogen 2.777 N/A ARG 103.A NH2 ASP 76.A OD2 no hydrogen 3.379 N/A SER 104.A N ASN 78.A OD1 no hydrogen 2.763 N/A ARG 105.A NE ARG 103.A O no hydrogen 2.841 N/A ARG 105.A NH1 ARG 103.A O no hydrogen 3.414 N/A ARG 105.A NH2 LEU 96.A O no hydrogen 2.707 N/A LEU 108.A N GLY 81.A O no hydrogen 2.880 N/A GLN 110.A N THR 83.A O no hydrogen 2.874 N/A GLN 110.A NE2 GLY 111.A O no hydrogen 2.909 N/A GLU 113.A N GLU 113.A OE2 no hydrogen 2.710 N/A ASP 114.A N GLY 111.A O no hydrogen 3.151 N/A PHE 115.A N TRP 112.A O no hydrogen 2.760 N/A VAL 119.A N ILE 146.A O no hydrogen 3.088 N/A ASP 120.A N THR 56.A O no hydrogen 2.868 N/A ARG 121.A NE LEU 49.A O no hydrogen 2.679 N/A ARG 121.A NE ASP 50.A O no hydrogen 3.188 N/A ARG 121.A NH1 ASP 120.A O no hydrogen 2.863 N/A ARG 121.A NH1 ASP 150.A OD1 no hydrogen 3.299 N/A ARG 121.A NH2 ASP 50.A OD2 no hydrogen 3.017 N/A ARG 121.A NH2 ASP 150.A OD2 no hydrogen 2.856 N/A ILE 122.A N ARG 152.A O no hydrogen 3.102 N/A VAL 123.A N LEU 58.A O no hydrogen 2.851 N/A SER 124.A N THR 154.A O no hydrogen 3.024 N/A SER 124.A OG ILE 60.A O no hydrogen 2.938 N/A GLU 126.A N GLN 156.A O no hydrogen 2.760 N/A GLU 129.A N GLU 129.A OE2 no hydrogen 2.707 N/A HIS 130.A N ALA 127.A O no hydrogen 2.853 N/A PHE 131.A N PHE 128.A O no hydrogen 2.931 N/A HIS 133.A NE2 LEU 194.A O no hydrogen 3.091 N/A ASN 135.A N GLY 132.A O no hydrogen 2.903 N/A TYR 136.A N HIS 133.A O no hydrogen 3.128 N/A PHE 139.A N ASN 135.A O no hydrogen 2.999 N/A PHE 140.A N TYR 136.A O no hydrogen 3.105 N/A LYS 141.A N ASP 137.A O no hydrogen 3.009 N/A ARG 142.A N ASP 138.A O no hydrogen 2.940 N/A ARG 142.A NH1 GLU 113.A O no hydrogen 2.816 N/A ARG 142.A NH1 PHE 115.A O no hydrogen 2.700 N/A ARG 142.A NH2 GLU 113.A O no hydrogen 3.413 N/A CYS 143.A N PHE 139.A O no hydrogen 2.918 N/A CYS 143.A SG PHE 139.A O no hydrogen 3.319 N/A PHE 144.A N PHE 140.A O no hydrogen 2.857 N/A ASN 145.A N LYS 141.A O no hydrogen 2.871 N/A ILE 146.A N ARG 142.A O no hydrogen 3.152 N/A GLY 151.A N PRO 148.A O no hydrogen 3.280 N/A ARG 152.A NH1 LYS 48.A O no hydrogen 2.924 N/A MET 153.A N TYR 274.A O no hydrogen 2.983 N/A THR 154.A N ILE 122.A O no hydrogen 3.054 N/A THR 154.A OG1 ASN 45.A OD1 no hydrogen 3.250 N/A VAL 155.A N VAL 272.A O no hydrogen 2.917 N/A GLN 156.A N SER 124.A O no hydrogen 2.902 N/A GLN 156.A NE2 CYS 24.A O no hydrogen 3.445 N/A GLN 156.A NE2 GLU 126.A OE1 no hydrogen 2.973 N/A SER 157.A N SER 270.A O no hydrogen 2.948 N/A SER 157.A OG SER 158.A O no hydrogen 2.747 N/A SER 158.A N GLU 129.A OE1 no hydrogen 2.797 N/A VAL 159.A N ASP 268.A O no hydrogen 2.893 N/A SER 160.A N PRO 195.A O no hydrogen 2.904 N/A TYR 164.A N HIS 162.A ND1 no hydrogen 2.950 N/A MET 166.A N HIS 162.A O no hydrogen 3.146 N/A ALA 167.A N PRO 163.A O no hydrogen 3.293 N/A ARG 169.A N MET 166.A O no hydrogen 3.217 N/A GLY 170.A N ALA 167.A O no hydrogen 2.861 N/A SER 174.A N GLY 170.A O no hydrogen 2.913 N/A PHE 175.A N LYS 171.A O no hydrogen 2.970 N/A GLU 176.A N LYS 172.A O no hydrogen 3.226 N/A THR 177.A N LEU 173.A O no hydrogen 2.916 N/A THR 177.A OG1 LEU 173.A O no hydrogen 2.854 N/A ALA 178.A N SER 174.A O no hydrogen 3.112 N/A ARG 179.A N PHE 175.A O no hydrogen 3.044 N/A PHE 180.A N GLU 176.A O no hydrogen 3.032 N/A ILE 181.A N THR 177.A O no hydrogen 2.857 N/A LYS 182.A N ALA 178.A O no hydrogen 3.018 N/A PHE 183.A N ARG 179.A O no hydrogen 3.055 N/A ILE 184.A N PHE 180.A O no hydrogen 2.995 N/A VAL 185.A N ILE 181.A O no hydrogen 3.059 N/A THR 186.A N PHE 183.A O no hydrogen 3.144 N/A THR 186.A OG1 LYS 182.A O no hydrogen 2.566 N/A GLU 187.A N PHE 183.A O no hydrogen 2.923 N/A ILE 188.A N ILE 184.A O no hydrogen 2.883 N/A PHE 189.A N ILE 184.A O no hydrogen 2.900 N/A GLY 192.A N PHE 189.A O no hydrogen 2.841 N/A ARG 193.A N GLU 129.A O no hydrogen 2.747 N/A THR 197.A OG1 SER 270.A OG no hydrogen 2.661 N/A MET 199.A N SER 196.A OG no hydrogen 3.279 N/A MET 200.A N SER 196.A O no hydrogen 3.088 N/A VAL 201.A N THR 197.A O no hydrogen 2.954 N/A GLU 202.A N GLU 198.A O no hydrogen 2.892 N/A HIS 203.A N MET 199.A O no hydrogen 3.008 N/A HIS 203.A ND1 ASP 137.A OD1 no hydrogen 2.936 N/A GLY 204.A N MET 200.A O no hydrogen 3.357 N/A GLU 205.A N VAL 201.A O no hydrogen 2.903 N/A LYS 206.A N GLU 202.A O no hydrogen 2.800 N/A ALA 207.A N HIS 203.A O no hydrogen 3.201 N/A ALA 207.A N GLY 204.A O no hydrogen 3.159 N/A GLY 208.A N GLU 205.A O no hydrogen 3.035 N/A PHE 209.A N GLY 204.A O no hydrogen 3.172 N/A THR 210.A N LEU 275.A O no hydrogen 2.664 N/A LEU 215.A N LEU 271.A O no hydrogen 2.938 N/A SER 216.A OG ASP 268.A OD1 no hydrogen 2.552 N/A SER 216.A OG ASP 268.A OD2 no hydrogen 3.501 N/A LEU 217.A N CYS 269.A O no hydrogen 2.789 N/A ARG 218.A NE LEU 267.A O no hydrogen 3.297 N/A ARG 218.A NH2 LEU 267.A O no hydrogen 2.963 N/A HIS 220.A N LEU 217.A O no hydrogen 2.801 N/A TYR 221.A N LEU 217.A O no hydrogen 3.144 N/A TYR 221.A N ARG 218.A O no hydrogen 3.172 N/A TYR 221.A OH GLU 126.A OE2 no hydrogen 2.575 N/A ILE 222.A N ARG 218.A O no hydrogen 3.059 N/A LYS 223.A N PRO 219.A O no hydrogen 3.187 N/A THR 224.A N HIS 220.A O no hydrogen 3.003 N/A THR 224.A OG1 HIS 220.A O no hydrogen 2.611 N/A LEU 225.A N TYR 221.A O no hydrogen 2.825 N/A ARG 226.A N ILE 222.A O no hydrogen 3.011 N/A ARG 226.A NE GLU 259.A OE1 no hydrogen 3.188 N/A ILE 227.A N LYS 223.A O no hydrogen 3.249 N/A TRP 228.A N THR 224.A O no hydrogen 2.803 N/A GLY 229.A N LEU 225.A O no hydrogen 2.830 N/A ASP 230.A N ARG 226.A O no hydrogen 2.786 N/A THR 231.A N ILE 227.A O no hydrogen 2.866 N/A THR 231.A OG1 ILE 227.A O no hydrogen 2.930 N/A LEU 232.A N TRP 228.A O no hydrogen 3.023 N/A GLN 233.A N GLY 229.A O no hydrogen 3.010 N/A SER 234.A N ASP 230.A O no hydrogen 2.958 N/A SER 234.A OG ASP 230.A O no hydrogen 3.529 N/A SER 234.A OG THR 231.A O no hydrogen 2.914 N/A ASN 235.A N THR 231.A O no hydrogen 3.050 N/A ASN 235.A N LEU 232.A O no hydrogen 2.894 N/A ASN 235.A ND2 LEU 14.A O no hydrogen 3.065 N/A LYS 236.A N GLN 233.A O no hydrogen 2.872 N/A ALA 239.A N ASN 235.A O no hydrogen 2.999 N/A ILE 240.A N LYS 236.A O no hydrogen 3.054 N/A GLU 241.A N ASP 237.A O no hydrogen 2.940 N/A VAL 242.A N LYS 238.A O no hydrogen 2.926 N/A THR 243.A N ALA 239.A O no hydrogen 2.912 N/A THR 243.A OG1 ALA 239.A O no hydrogen 2.777 N/A THR 243.A OG1 SER 244.A O no hydrogen 3.490 N/A TYR 248.A N SER 244.A O no hydrogen 3.123 N/A ASN 249.A N GLU 245.A O no hydrogen 2.944 N/A ARG 250.A N GLU 246.A O no hydrogen 2.820 N/A ARG 250.A NE GLU 187.A OE2 no hydrogen 3.188 N/A ARG 250.A NH1 GLU 246.A OE1 no hydrogen 3.224 N/A ARG 250.A NH2 GLU 246.A OE1 no hydrogen 2.538 N/A TYR 251.A N VAL 247.A O no hydrogen 3.140 N/A MET 252.A N TYR 248.A O no hydrogen 2.942 N/A LYS 253.A N ASN 249.A O no hydrogen 2.974 N/A TYR 254.A N ARG 250.A O no hydrogen 3.120 N/A LEU 255.A N TYR 251.A O no hydrogen 2.885 N/A ARG 256.A N MET 252.A O no hydrogen 2.992 N/A ARG 256.A NH1 ASP 230.A OD1 no hydrogen 2.897 N/A ARG 256.A NH2 ASP 230.A OD1 no hydrogen 2.636 N/A GLY 257.A N LYS 253.A O no hydrogen 2.693 N/A CYS 258.A N TYR 254.A O no hydrogen 2.868 N/A CYS 258.A SG TYR 254.A O no hydrogen 3.378 N/A GLU 259.A N LEU 255.A O no hydrogen 3.078 N/A HIS 260.A N ARG 256.A O no hydrogen 2.958 N/A TYR 261.A N GLY 257.A O no hydrogen 2.843 N/A TYR 261.A OH GLU 176.A OE2 no hydrogen 2.524 N/A PHE 262.A N CYS 258.A O no hydrogen 2.759 N/A THR 263.A N GLU 259.A O no hydrogen 2.939 N/A THR 263.A OG1 GLU 259.A O no hydrogen 2.782 N/A ASP 264.A N HIS 260.A O no hydrogen 2.883 N/A GLU 265.A N PHE 262.A O no hydrogen 2.967 N/A MET 266.A N TYR 261.A O no hydrogen 2.667 N/A LEU 267.A N TYR 261.A O no hydrogen 3.277 N/A ASP 268.A N VAL 159.A O no hydrogen 3.005 N/A CYS 269.A SG GLU 126.A OE1 no hydrogen 3.766 N/A SER 270.A N SER 157.A O no hydrogen 2.967 N/A SER 270.A OG THR 197.A OG1 no hydrogen 2.661 N/A LEU 271.A N LEU 215.A O no hydrogen 2.834 N/A VAL 272.A N VAL 155.A O no hydrogen 2.865 N/A TYR 274.A N MET 153.A O no hydrogen 2.845 N/A TYR 274.A OH MET 200.A O no hydrogen 2.819 N/A LEU 275.A N THR 210.A O no hydrogen 2.875 N/A LYS 276.A N GLY 151.A O no hydrogen 3.129 N/A LYS 276.A NZ PHE 144.A O no hydrogen 2.943 N/A LYS 276.A NZ MET 147.A O no hydrogen 2.877 N/A LYS 276.A NZ PRO 148.A O no hydrogen 3.012 N/A ALA 279.A N LYS 276.A O no hydrogen 2.799 N/A