Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vus_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 GLY 7.A O no hydrogen 2.962 N/A GLY 7.A N PRO 4.A O no hydrogen 2.977 N/A PHE 8.A N ALA 233.A O no hydrogen 3.087 N/A VAL 9.A N ALA 67.A O no hydrogen 3.039 N/A ILE 11.A N VAL 69.A O no hydrogen 2.980 N/A SER 12.A N VAL 244.A O no hydrogen 2.830 N/A SER 12.A OG ASP 73.A OD2 no hydrogen 3.142 N/A TRP 13.A N THR 71.A O no hydrogen 2.890 N/A TRP 13.A NE1 GLN 36.A OE1 no hydrogen 2.806 N/A ASN 15.A N PHE 25.A O no hydrogen 3.033 N/A ASN 15.A ND2 SER 27.A OG no hydrogen 3.339 N/A VAL 16.A N SER 78.A OG no hydrogen 3.089 N/A GLU 17.A N VAL 28.A O no hydrogen 2.921 N/A ASP 22.A N GLU 17.A OE1 no hydrogen 2.909 N/A ARG 24.A N ASP 22.A OD1 no hydrogen 3.105 N/A PHE 25.A N ASP 22.A O no hydrogen 2.814 N/A MET 26.A N GLN 23.A O no hydrogen 2.938 N/A SER 27.A N ASP 22.A O no hydrogen 3.206 N/A SER 27.A OG GLU 17.A OE1 no hydrogen 3.194 N/A SER 27.A OG ASP 22.A O no hydrogen 3.023 N/A VAL 28.A N ASN 15.A O no hydrogen 3.019 N/A ARG 29.A N ASN 249.A OD1 no hydrogen 3.013 N/A ARG 29.A NE GLU 19.A O no hydrogen 2.565 N/A THR 30.A N GLU 17.A O no hydrogen 2.967 N/A THR 30.A OG1 ASP 18.A OD1 no hydrogen 2.710 N/A LEU 33.A N ARG 29.A O no hydrogen 2.897 N/A ARG 34.A N THR 30.A O no hydrogen 3.064 N/A GLU 35.A N SER 31.A O no hydrogen 2.964 N/A GLN 36.A N ALA 32.A O no hydrogen 2.808 N/A PHE 37.A N LEU 33.A O no hydrogen 2.925 N/A ALA 38.A N ARG 34.A O no hydrogen 2.884 N/A TRP 39.A N GLU 35.A O no hydrogen 2.811 N/A LEU 40.A N GLN 36.A O no hydrogen 2.925 N/A ARG 41.A N PHE 37.A O no hydrogen 3.067 N/A GLU 42.A N ALA 38.A O no hydrogen 2.835 N/A ASN 43.A N TRP 39.A O no hydrogen 2.934 N/A ASN 43.A N LEU 40.A O no hydrogen 3.312 N/A ASN 43.A ND2 TRP 39.A O no hydrogen 2.951 N/A GLY 44.A N ARG 41.A O no hydrogen 3.241 N/A TYR 45.A N LEU 40.A O no hydrogen 2.899 N/A GLN 46.A N LYS 66.A O no hydrogen 2.932 N/A GLN 46.A NE2 GLY 44.A O no hydrogen 3.273 N/A VAL 48.A N VAL 68.A O no hydrogen 2.810 N/A SER 49.A N GLN 52.A OE1 no hydrogen 2.889 N/A SER 49.A OG GLN 52.A OE1 no hydrogen 3.447 N/A GLN 52.A N SER 49.A OG no hydrogen 3.102 N/A ILE 53.A N SER 49.A O no hydrogen 3.094 N/A ARG 54.A N ILE 50.A O no hydrogen 2.882 N/A ARG 54.A NE ASP 223.A OD2 no hydrogen 2.862 N/A ARG 54.A NH2 ASP 223.A OD1 no hydrogen 3.141 N/A GLU 55.A N ALA 51.A O no hydrogen 2.888 N/A ALA 56.A N GLN 52.A O no hydrogen 3.146 N/A HIS 57.A N ILE 53.A O no hydrogen 2.928 N/A HIS 57.A ND1 ALA 235.A O no hydrogen 2.792 N/A ARG 58.A N ARG 54.A O no hydrogen 2.945 N/A GLY 59.A N ALA 56.A O no hydrogen 3.079 N/A GLY 60.A N GLU 55.A O no hydrogen 2.722 N/A LYS 61.A N GLU 55.A OE1 no hydrogen 3.321 N/A LEU 63.A N ASN 6.A OD1 no hydrogen 2.796 N/A LYS 66.A NZ ASN 43.A O no hydrogen 2.766 N/A VAL 68.A N GLN 46.A O no hydrogen 2.945 N/A VAL 69.A N VAL 9.A O no hydrogen 2.868 N/A THR 71.A N ILE 11.A O no hydrogen 2.813 N/A THR 71.A OG1 ILE 11.A O no hydrogen 2.661 N/A PHE 72.A N VAL 95.A O no hydrogen 2.877 N/A ASP 73.A N TRP 13.A O no hydrogen 2.920 N/A ASP 74.A N ALA 97.A O no hydrogen 2.858 N/A TYR 76.A OH ASP 74.A OD2 no hydrogen 2.771 N/A GLN 77.A N TYR 122.A O no hydrogen 2.802 N/A GLN 77.A NE2 GLU 121.A O no hydrogen 2.813 N/A SER 78.A OG ASN 15.A OD1 no hydrogen 2.591 N/A PHE 79.A N TYR 76.A O no hydrogen 2.988 N/A TYR 80.A OH GLU 131.A OE1 no hydrogen 2.762 N/A THR 81.A N GLN 77.A O no hydrogen 2.924 N/A THR 81.A OG1 GLN 77.A O no hydrogen 3.565 N/A ARG 82.A N SER 78.A O no hydrogen 2.790 N/A ARG 82.A NE ASP 18.A OD1 no hydrogen 2.865 N/A ARG 82.A NE ASP 18.A OD2 no hydrogen 3.427 N/A ARG 82.A NH1 THR 81.A O no hydrogen 3.107 N/A ARG 82.A NH2 ASP 18.A OD2 no hydrogen 2.898 N/A VAL 83.A N SER 78.A O no hydrogen 3.112 N/A VAL 83.A N PHE 79.A O no hydrogen 3.088 N/A PHE 84.A N PHE 79.A O no hydrogen 2.770 N/A LEU 87.A N VAL 83.A O no hydrogen 2.876 N/A GLN 88.A N PHE 84.A O no hydrogen 2.799 N/A ALA 89.A N PRO 85.A O no hydrogen 2.893 N/A PHE 90.A N ILE 86.A O no hydrogen 2.910 N/A GLN 91.A N GLN 88.A O no hydrogen 3.184 N/A GLN 91.A NE2 GLN 88.A O no hydrogen 2.933 N/A TRP 92.A N LEU 87.A O no hydrogen 3.049 N/A ALA 94.A N LEU 137.A O no hydrogen 3.228 N/A VAL 95.A N LEU 70.A O no hydrogen 2.883 N/A TRP 96.A N GLU 139.A O no hydrogen 2.865 N/A ALA 97.A N PHE 72.A O no hydrogen 2.930 N/A VAL 99.A N ASP 74.A O no hydrogen 3.344 N/A GLY 100.A N THR 144.A O no hydrogen 2.916 N/A SER 101.A N TRP 145.A O no hydrogen 2.750 N/A TRP 102.A N VAL 99.A O no hydrogen 3.108 N/A VAL 103.A N VAL 99.A O no hydrogen 3.167 N/A ASP 104.A N GLY 100.A O no hydrogen 2.854 N/A THR 105.A N TRP 102.A O no hydrogen 3.260 N/A THR 105.A OG1 TRP 102.A O no hydrogen 2.834 N/A LYS 109.A N PRO 106.A O no hydrogen 2.966 N/A VAL 111.A N VAL 118.A O no hydrogen 2.698 N/A PHE 113.A N GLU 116.A O no hydrogen 2.981 N/A VAL 118.A N VAL 111.A O no hydrogen 2.771 N/A ARG 120.A NE THR 105.A O no hydrogen 3.009 N/A ARG 120.A NH1 ARG 120.A O no hydrogen 2.847 N/A ARG 120.A NH1 PHE 123.A O no hydrogen 2.720 N/A ARG 120.A NH1 ALA 124.A O no hydrogen 3.065 N/A ARG 120.A NH2 THR 105.A O no hydrogen 3.182 N/A ARG 120.A NH2 ALA 124.A O no hydrogen 2.881 N/A TYR 122.A N ASP 119.A O no hydrogen 3.040 N/A PHE 123.A N ARG 120.A O no hydrogen 2.969 N/A ALA 124.A N GLY 75.A O no hydrogen 2.925 N/A THR 125.A N GLN 128.A OE1 no hydrogen 2.973 N/A TRP 126.A NE1 ASP 104.A OD1 no hydrogen 2.837 N/A GLN 128.A N THR 125.A OG1 no hydrogen 2.993 N/A GLN 128.A NE2 GLN 77.A OE1 no hydrogen 2.962 N/A VAL 129.A N THR 125.A O no hydrogen 2.965 N/A ARG 130.A N TRP 126.A O no hydrogen 2.934 N/A ARG 130.A NH1 LYS 194.A O no hydrogen 2.594 N/A GLU 131.A N GLN 127.A O no hydrogen 3.092 N/A VAL 132.A N GLN 128.A O no hydrogen 3.058 N/A ALA 133.A N VAL 129.A O no hydrogen 2.935 N/A ARG 134.A N ARG 130.A O no hydrogen 2.901 N/A SER 135.A N GLU 131.A O no hydrogen 3.241 N/A SER 135.A N VAL 132.A O no hydrogen 3.066 N/A SER 135.A OG VAL 132.A O no hydrogen 2.528 N/A ARG 136.A N ALA 133.A O no hydrogen 2.825 N/A LEU 137.A N SER 135.A OG no hydrogen 3.172 N/A GLU 139.A N ALA 94.A O no hydrogen 2.936 N/A ALA 141.A N TRP 96.A O no hydrogen 2.848 N/A SER 142.A N VAL 201.A O no hydrogen 2.916 N/A HIS 143.A N PRO 98.A O no hydrogen 3.101 N/A HIS 143.A ND1 VAL 203.A O no hydrogen 2.794 N/A THR 144.A N SER 142.A OG no hydrogen 3.055 N/A THR 144.A OG1 HIS 143.A O no hydrogen 2.604 N/A TRP 145.A N ASP 183.A OD1 no hydrogen 2.824 N/A ASN 146.A N ASP 183.A OD2 no hydrogen 2.836 N/A SER 147.A N THR 144.A OG1 no hydrogen 2.923 N/A SER 147.A OG ASP 183.A OD2 no hydrogen 2.731 N/A HIS 148.A ND1 HIS 148.A O no hydrogen 2.861 N/A ILE 151.A N LEU 155.A O no hydrogen 2.781 N/A VAL 157.A N TYR 149.A O no hydrogen 2.926 N/A TYR 158.A OH ILE 180.A O no hydrogen 2.883 N/A VAL 159.A N PRO 156.A O no hydrogen 3.336 N/A ASN 160.A ND2 PRO 156.A O no hydrogen 2.886 N/A ARG 161.A NE GLU 171.A O no hydrogen 2.678 N/A ARG 161.A NH2 GLU 171.A O no hydrogen 2.935 N/A ALA 162.A N GLU 171.A OE1 no hydrogen 2.947 N/A TYR 163.A N GLN 152.A O no hydrogen 2.991 N/A PHE 164.A N ARG 169.A O no hydrogen 2.767 N/A ALA 168.A N THR 165.A O no hydrogen 3.298 N/A ARG 169.A N PHE 164.A O no hydrogen 3.260 N/A ARG 169.A NH1 GLU 175.A OE2 no hydrogen 2.910 N/A ARG 169.A NH2 TYR 170.A O no hydrogen 3.161 N/A ARG 169.A NH2 GLU 175.A OE1 no hydrogen 2.919 N/A ARG 169.A NH2 GLU 175.A OE2 no hydrogen 3.543 N/A GLU 171.A N ALA 162.A O no hydrogen 2.791 N/A THR 172.A N GLU 175.A OE1 no hydrogen 2.831 N/A THR 172.A OG1 GLU 175.A OE1 no hydrogen 3.261 N/A GLU 175.A N THR 172.A OG1 no hydrogen 2.993 N/A TYR 176.A N THR 172.A O no hydrogen 2.769 N/A TYR 176.A OH TYR 158.A O no hydrogen 2.679 N/A ARG 177.A N ALA 173.A O no hydrogen 2.914 N/A ARG 177.A NH1 GLU 215.A OE2 no hydrogen 3.129 N/A ARG 177.A NH1 GLU 216.A OE2 no hydrogen 2.669 N/A ARG 177.A NH2 GLU 215.A OE1 no hydrogen 3.455 N/A GLU 178.A N ALA 174.A O no hydrogen 3.124 N/A ARG 179.A N GLU 175.A O no hydrogen 2.909 N/A ARG 179.A NE GLU 171.A OE2 no hydrogen 2.834 N/A ARG 179.A NH1 VAL 157.A O no hydrogen 2.870 N/A ARG 179.A NH2 VAL 157.A O no hydrogen 3.282 N/A ARG 179.A NH2 ASN 160.A O no hydrogen 2.945 N/A ARG 179.A NH2 GLU 171.A OE1 no hydrogen 2.901 N/A ILE 180.A N TYR 176.A O no hydrogen 2.977 N/A ARG 181.A N ARG 177.A O no hydrogen 2.848 N/A ARG 181.A NE GLU 178.A OE1 no hydrogen 2.770 N/A ARG 181.A NH2 GLU 178.A OE1 no hydrogen 3.420 N/A ARG 181.A NH2 GLU 178.A OE2 no hydrogen 2.951 N/A LEU 182.A N GLU 178.A O no hydrogen 2.924 N/A ASP 183.A N ARG 179.A O no hydrogen 3.084 N/A ALA 184.A N ILE 180.A O no hydrogen 3.131 N/A VAL 185.A N ARG 181.A O no hydrogen 2.807 N/A LYS 186.A N LEU 182.A O no hydrogen 3.080 N/A MET 187.A N ASP 183.A O no hydrogen 2.901 N/A THR 188.A N ALA 184.A O no hydrogen 2.850 N/A THR 188.A OG1 ALA 184.A O no hydrogen 2.707 N/A THR 188.A OG1 TYR 222.A OH no hydrogen 2.721 N/A GLU 189.A N VAL 185.A O no hydrogen 2.921 N/A TYR 190.A N LYS 186.A O no hydrogen 2.917 N/A LEU 191.A N MET 187.A O no hydrogen 2.948 N/A ARG 192.A N THR 188.A O no hydrogen 3.045 N/A ARG 192.A NE ASN 198.A OD1 no hydrogen 2.580 N/A ARG 192.A NH2 ASN 198.A OD1 no hydrogen 2.748 N/A THR 193.A N GLU 189.A O no hydrogen 2.872 N/A THR 193.A OG1 GLU 189.A O no hydrogen 2.938 N/A LYS 194.A N TYR 190.A O no hydrogen 2.812 N/A VAL 195.A N LEU 191.A O no hydrogen 3.174 N/A VAL 197.A N LEU 191.A O no hydrogen 3.119 N/A HIS 200.A ND1 GLY 221.A O no hydrogen 2.837 N/A PHE 202.A N MET 224.A O no hydrogen 2.862 N/A VAL 203.A N SER 142.A O no hydrogen 2.916 N/A TRP 204.A N PHE 226.A O no hydrogen 3.159 N/A GLY 207.A N TRP 204.A O no hydrogen 3.053 N/A GLU 208.A N PRO 205.A O no hydrogen 3.267 N/A ASN 210.A ND2 VAL 159.A O no hydrogen 3.187 N/A ALA 213.A N ASN 210.A OD1 no hydrogen 3.040 N/A ILE 214.A N ASN 210.A O no hydrogen 2.877 N/A GLU 215.A N GLY 211.A O no hydrogen 3.080 N/A GLU 216.A N ILE 212.A O no hydrogen 3.025 N/A LEU 217.A N ALA 213.A O no hydrogen 2.916 N/A LYS 218.A N ILE 214.A O no hydrogen 2.939 N/A LYS 218.A NZ ASP 239.A OD1 no hydrogen 2.746 N/A LYS 219.A N GLU 215.A O no hydrogen 3.105 N/A LYS 219.A NZ GLU 215.A OE2 no hydrogen 3.533 N/A LYS 219.A NZ GLU 216.A OE2 no hydrogen 2.914 N/A LEU 220.A N GLU 216.A O no hydrogen 3.296 N/A LEU 220.A N LEU 217.A O no hydrogen 2.978 N/A GLY 221.A N LYS 218.A O no hydrogen 3.114 N/A TYR 222.A N LEU 217.A O no hydrogen 3.158 N/A TYR 222.A OH THR 188.A OG1 no hydrogen 2.721 N/A ASP 223.A N HIS 200.A O no hydrogen 2.733 N/A MET 224.A N HIS 200.A O no hydrogen 3.327 N/A PHE 225.A N LEU 238.A O no hydrogen 3.008 N/A PHE 226.A N PHE 202.A O no hydrogen 2.889 N/A THR 227.A N ILE 241.A O no hydrogen 2.914 N/A THR 227.A OG1 ILE 241.A O no hydrogen 3.133 N/A GLU 229.A N THR 227.A OG1 no hydrogen 2.964 N/A ALA 233.A N PHE 8.A O no hydrogen 2.925 N/A ASN 234.A ND2 HIS 5.A O no hydrogen 2.867 N/A ALA 235.A N ASN 6.A O no hydrogen 2.910 N/A SER 236.A N ASN 234.A OD1 no hydrogen 2.893 N/A SER 236.A OG ASN 234.A OD1 no hydrogen 3.230 N/A GLN 237.A N ASN 234.A O no hydrogen 3.022 N/A GLN 237.A NE2 SER 240.A O no hydrogen 2.835 N/A SER 240.A N GLN 237.A OE1 no hydrogen 3.021 N/A ILE 241.A N PHE 225.A O no hydrogen 2.832 N/A ARG 243.A N GLU 229.A O no hydrogen 3.065 N/A ARG 243.A NE THR 227.A O no hydrogen 2.868 N/A ARG 243.A NH1 ASP 73.A OD2 no hydrogen 2.830 N/A ARG 243.A NH2 THR 71.A OG1 no hydrogen 2.876 N/A ARG 243.A NH2 ASP 73.A OD1 no hydrogen 2.879 N/A ARG 243.A NH2 ASP 73.A OD2 no hydrogen 3.125 N/A VAL 244.A N ALA 10.A O no hydrogen 2.757 N/A ILE 246.A N SER 12.A O no hydrogen 3.033 N/A SER 251.A N GLU 254.A OE1 no hydrogen 2.995 N/A GLU 254.A N SER 251.A OG no hydrogen 3.016 N/A PHE 255.A N SER 251.A O no hydrogen 2.853 N/A ALA 256.A N LEU 252.A O no hydrogen 2.846 N/A GLN 257.A N LYS 253.A O no hydrogen 3.004 N/A GLN 258.A N GLU 254.A O no hydrogen 2.988 N/A GLN 258.A NE2 LEU 245.A O no hydrogen 2.965 N/A ILE 259.A N PHE 255.A O no hydrogen 3.097 N/A ILE 260.A N ALA 256.A O no hydrogen 2.784 N/A THR 261.A N GLN 257.A O no hydrogen 3.044 N/A THR 261.A OG1 GLN 257.A O no hydrogen 2.708 N/A VAL 262.A N ILE 259.A O no hydrogen 3.328 N/A