Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bw8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N VAL 35.A O no hydrogen 3.041 N/A LEU 4.A N ILE 33.A O no hydrogen 2.799 N/A GLY 6.A N ASP 9.A OD1 no hydrogen 3.407 N/A ARG 7.A NE VAL 24.A O no hydrogen 2.717 N/A ARG 7.A NH2 VAL 24.A O no hydrogen 3.536 N/A ARG 7.A NH2 TRP 25.A O no hydrogen 3.547 N/A ASP 9.A N GLY 6.A O no hydrogen 3.196 N/A ALA 10.A N ASP 9.A OD2 no hydrogen 3.126 N/A ARG 11.A N VAL 20.A O no hydrogen 2.952 N/A ARG 11.A NH1 ALA 10.A O no hydrogen 3.007 N/A VAL 13.A N TYR 18.A O no hydrogen 2.942 N/A ALA 14.A N LEU 37.A O no hydrogen 3.148 N/A GLY 16.A N VAL 13.A O no hydrogen 2.917 N/A ARG 17.A N ALA 14.A O no hydrogen 3.182 N/A ARG 17.A NE TYR 18.A OH no hydrogen 3.067 N/A ARG 17.A NH2 VAL 221.A O no hydrogen 2.828 N/A TYR 18.A N VAL 13.A O no hydrogen 3.398 N/A ARG 19.A N TYR 62.A O no hydrogen 3.088 N/A ARG 19.A NH1 ASP 12.A OD1 no hydrogen 3.181 N/A VAL 20.A N ARG 11.A O no hydrogen 2.912 N/A ILE 21.A N ALA 60.A O no hydrogen 2.857 N/A ASN 22.A N ASP 9.A O no hydrogen 2.896 N/A ASN 22.A ND2 GLY 6.A O no hydrogen 2.861 N/A ASN 22.A ND2 GLN 31.A O no hydrogen 3.084 N/A ASN 23.A ND2 TYR 58.A O no hydrogen 2.946 N/A VAL 24.A N ARG 7.A O no hydrogen 3.046 N/A GLY 26.A N ALA 56.A O no hydrogen 2.805 N/A THR 29.A OG1 HIS 49.A ND1 no hydrogen 2.735 N/A GLN 31.A NE2 ASN 22.A O no hydrogen 2.909 N/A GLN 31.A NE2 ASN 22.A OD1 no hydrogen 2.815 N/A CYS 32.A N ARG 46.A O no hydrogen 2.912 N/A ILE 33.A N LEU 4.A O no hydrogen 2.966 N/A GLU 34.A N THR 43.A O no hydrogen 2.879 N/A VAL 35.A N VAL 2.A O no hydrogen 2.833 N/A GLY 36.A N ASN 41.A O no hydrogen 2.816 N/A GLY 40.A N GLY 36.A O no hydrogen 2.754 N/A ASN 41.A N THR 39.A OG1 no hydrogen 3.013 N/A PHE 42.A N SER 216.A O no hydrogen 2.894 N/A THR 43.A N GLU 34.A O no hydrogen 3.040 N/A ILE 44.A N LEU 214.A O no hydrogen 2.920 N/A THR 45.A N CYS 32.A O no hydrogen 2.946 N/A THR 45.A OG1 GLU 3.A OE2 no hydrogen 2.693 N/A THR 45.A OG1 CYS 32.A O no hydrogen 3.341 N/A ARG 46.A N CYS 32.A O no hydrogen 3.342 N/A ARG 46.A NE ASP 48.A OD1 no hydrogen 3.400 N/A ARG 46.A NE ASP 48.A OD2 no hydrogen 3.249 N/A ARG 46.A NH2 ASP 48.A OD2 no hydrogen 2.927 N/A ASP 48.A N ALA 30.A O no hydrogen 2.873 N/A HIS 49.A ND1 THR 29.A OG1 no hydrogen 2.735 N/A HIS 49.A NE2 GLN 31.A OE1 no hydrogen 2.720 N/A ASN 51.A N TRP 208.A O no hydrogen 2.969 N/A ASN 54.A N ASN 51.A O no hydrogen 3.419 N/A ALA 56.A N LEU 207.A O no hydrogen 2.767 N/A TYR 58.A N ASN 23.A O no hydrogen 3.069 N/A TYR 58.A OH ALA 103.A O no hydrogen 2.753 N/A ALA 60.A N ILE 21.A O no hydrogen 3.042 N/A ILE 61.A N THR 203.A O no hydrogen 2.914 N/A TYR 62.A N ARG 19.A O no hydrogen 2.861 N/A TYR 62.A OH ALA 69.A O no hydrogen 2.819 N/A PHE 63.A N VAL 201.A O no hydrogen 2.932 N/A GLY 64.A N THR 71.A OG1 no hydrogen 2.905 N/A CYS 65.A N HIS 199.A O no hydrogen 2.793 N/A HIS 66.A N ALA 69.A O no hydrogen 2.999 N/A HIS 66.A ND1 GLU 202.A OE2 no hydrogen 2.625 N/A TRP 67.A N TYR 118.A OH no hydrogen 2.973 N/A GLY 68.A N SER 114.A OG no hydrogen 2.900 N/A ALA 69.A N HIS 66.A O no hydrogen 3.019 N/A CYS 70.A SG GLY 68.A O no hydrogen 3.972 N/A THR 71.A N GLY 64.A O no hydrogen 2.896 N/A THR 71.A OG1 ARG 17.A O no hydrogen 3.487 N/A THR 71.A OG1 GLY 64.A O no hydrogen 3.494 N/A SER 72.A N.A GLY 16.A O no hydrogen 2.934 N/A SER 72.A N.B GLY 16.A O no hydrogen 2.943 N/A LEU 76.A N SER 74.A OG no hydrogen 3.036 N/A ARG 78.A N LEU 198.A O no hydrogen 3.195 N/A ARG 79.A NE TYR 197.A OH no hydrogen 3.413 N/A VAL 80.A N TRP 196.A O no hydrogen 2.848 N/A GLN 81.A N PRO 194.A O no hydrogen 2.918 N/A GLU 82.A N ARG 79.A O no hydrogen 2.870 N/A LEU 83.A N VAL 80.A O no hydrogen 3.053 N/A SER 84.A N.A GLN 224.A O.A no hydrogen 2.811 N/A SER 84.A N.A GLN 224.A O.B no hydrogen 2.832 N/A SER 84.A N.B GLN 224.A O.A no hydrogen 2.788 N/A SER 84.A N.B GLN 224.A O.B no hydrogen 2.808 N/A SER 84.A OG.A GLN 224.A O.A no hydrogen 2.911 N/A SER 84.A OG.A GLN 224.A O.B no hydrogen 3.010 N/A ASP 85.A N GLN 224.A O.A no hydrogen 3.305 N/A ASP 85.A N GLN 224.A O.B no hydrogen 3.360 N/A ARG 87.A N THR 222.A O no hydrogen 3.035 N/A ARG 87.A NE ASP 85.A OD1 no hydrogen 2.931 N/A ARG 87.A NH1 GLU 176.A O no hydrogen 3.049 N/A THR 88.A N LEU 177.A O no hydrogen 3.182 N/A THR 88.A OG1 TYR 104.A OH no hydrogen 2.756 N/A THR 88.A OG1 SER 220.A O.A no hydrogen 2.831 N/A THR 88.A OG1 SER 220.A O.B no hydrogen 2.713 N/A SER 89.A N SER 220.A O.A no hydrogen 2.967 N/A SER 89.A N SER 220.A O.B no hydrogen 3.076 N/A TRP 90.A N VAL 174.A O no hydrogen 3.009 N/A TRP 90.A NE1 SER 216.A OG no hydrogen 2.789 N/A THR 91.A N ALA 217.A O no hydrogen 2.904 N/A THR 91.A OG1 ASP 218.A OD2 no hydrogen 2.726 N/A LEU 92.A N THR 172.A O no hydrogen 2.861 N/A THR 93.A N ARG 215.A O no hydrogen 2.922 N/A ARG 99.A N.A GLU 209.A O no hydrogen 2.871 N/A ARG 99.A N.B GLU 209.A O no hydrogen 2.886 N/A ARG 99.A NE.B GLU 209.A OE1 no hydrogen 3.017 N/A ARG 99.A NH1.A GLY 52.A O no hydrogen 2.527 N/A ARG 99.A NH1.B GLY 52.A O no hydrogen 2.825 N/A ARG 99.A NH2.A GLY 52.A O no hydrogen 3.120 N/A ARG 99.A NH2.B GLY 52.A O no hydrogen 2.893 N/A TRP 100.A N ASN 131.A O no hydrogen 3.280 N/A TRP 100.A NE1 THR 97.A O no hydrogen 2.865 N/A ASN 101.A N GLU 206.A O no hydrogen 3.003 N/A ASN 101.A ND2 GLU 206.A OE1 no hydrogen 2.912 N/A ALA 102.A N ASN 129.A O no hydrogen 2.839 N/A ALA 103.A N GLY 204.A O no hydrogen 2.948 N/A TYR 104.A N ILE 126.A O no hydrogen 2.902 N/A TYR 104.A OH THR 88.A OG1 no hydrogen 2.756 N/A ASP 105.A N GLU 202.A O no hydrogen 2.853 N/A ILE 106.A N LEU 124.A O no hydrogen 2.840 N/A TRP 107.A N ALA 200.A O no hydrogen 3.091 N/A PHE 108.A N ALA 122.A O no hydrogen 2.899 N/A SER 109.A N TYR 197.A O no hydrogen 3.021 N/A SER 109.A OG VAL 111.A O no hydrogen 3.045 N/A SER 109.A OG HIS 199.A NE2 no hydrogen 3.125 N/A VAL 111.A N SER 109.A OG no hydrogen 3.275 N/A GLY 115.A N ASN 113.A OD1.A no hydrogen 2.923 N/A GLY 117.A N SER 114.A O no hydrogen 3.035 N/A TYR 118.A OH CYS 65.A O no hydrogen 2.775 N/A SER 119.A OG.A ASP 159.A OD1.A no hydrogen 2.515 N/A SER 119.A OG.B ASP 159.A OD1.A no hydrogen 2.681 N/A GLY 120.A N ASP 159.A O.A no hydrogen 3.017 N/A GLY 120.A N ASP 159.A O.B no hydrogen 2.955 N/A GLY 121.A N TYR 118.A O no hydrogen 2.937 N/A ALA 122.A N PHE 108.A O no hydrogen 3.030 N/A GLU 123.A N ASN 161.A O no hydrogen 2.766 N/A LEU 124.A N ILE 106.A O no hydrogen 2.829 N/A MET 125.A N ILE 163.A O no hydrogen 2.729 N/A ILE 126.A N TYR 104.A O no hydrogen 3.098 N/A TRP 127.A N TYR 165.A O no hydrogen 2.808 N/A LEU 128.A N ALA 102.A O no hydrogen 2.912 N/A ASN 129.A N ALA 102.A O no hydrogen 3.434 N/A ASN 129.A ND2 THR 171.A O no hydrogen 3.004 N/A TRP 130.A N ASN 129.A OD1 no hydrogen 2.805 N/A ASN 131.A N TRP 100.A O no hydrogen 2.974 N/A ASN 131.A ND2 THR 96.A O no hydrogen 3.514 N/A ASN 131.A ND2 GLY 98.A O no hydrogen 2.858 N/A GLY 137.A N TYR 162.A OH no hydrogen 3.190 N/A SER 139.A N.A TYR 155.A O no hydrogen 3.042 N/A SER 139.A N.B TYR 155.A O no hydrogen 3.059 N/A ARG 140.A NH1 GLU 152.A OE1 no hydrogen 3.393 N/A VAL 141.A N VAL 153.A O no hydrogen 2.780 N/A VAL 144.A N TRP 151.A O no hydrogen 2.873 N/A LEU 146.A N ALA 149.A O no hydrogen 2.871 N/A ALA 149.A N LEU 146.A O no hydrogen 2.943 N/A TRP 151.A N VAL 144.A O no hydrogen 2.810 N/A TRP 151.A NE1 LEU 146.A O no hydrogen 2.881 N/A GLU 152.A N ARG 166.A O no hydrogen 2.768 N/A VAL 153.A N ALA 142.A O no hydrogen 2.831 N/A TRP 154.A N ALA 164.A O no hydrogen 2.781 N/A TRP 154.A NE1 GLU 152.A OE1 no hydrogen 2.905 N/A TYR 155.A N SER 139.A O.A no hydrogen 2.943 N/A TYR 155.A N SER 139.A O.B no hydrogen 2.934 N/A ALA 156.A N TYR 162.A O no hydrogen 2.960 N/A TRP 158.A N TRP 160.A O no hydrogen 3.115 N/A TRP 160.A NE1 GLU 123.A OE1 no hydrogen 2.966 N/A ASN 161.A N GLY 121.A O no hydrogen 2.931 N/A TYR 162.A N ALA 156.A O no hydrogen 2.890 N/A ILE 163.A N GLU 123.A O no hydrogen 2.860 N/A ALA 164.A N TRP 154.A O no hydrogen 2.858 N/A TYR 165.A N MET 125.A O no hydrogen 2.856 N/A TYR 165.A OH ASP 185.A OD1 no hydrogen 2.672 N/A ARG 166.A N GLU 152.A O no hydrogen 2.811 N/A ARG 166.A NE GLU 152.A OE1 no hydrogen 3.218 N/A ARG 166.A NH2 GLU 152.A OE1 no hydrogen 3.065 N/A ARG 167.A N TRP 127.A O no hydrogen 3.136 N/A ARG 167.A NH1 THR 169.A O no hydrogen 2.854 N/A THR 168.A N THR 150.A O no hydrogen 2.966 N/A THR 168.A OG1 THR 150.A O no hydrogen 3.351 N/A THR 171.A N LEU 128.A O no hydrogen 2.925 N/A THR 171.A OG1 SER 173.A O no hydrogen 3.446 N/A VAL 174.A N TRP 90.A O no hydrogen 2.960 N/A GLU 176.A N SER 89.A OG no hydrogen 2.985 N/A LEU 177.A N THR 88.A O no hydrogen 2.790 N/A LEU 179.A N VAL 86.A O no hydrogen 2.955 N/A LYS 180.A NZ ASP 184.A OD1 no hydrogen 2.828 N/A LYS 180.A NZ ASP 184.A OD2 no hydrogen 3.403 N/A ALA 181.A N ASP 178.A O no hydrogen 3.297 N/A ALA 181.A N ASP 178.A OD1 no hydrogen 3.260 N/A PHE 182.A N LEU 179.A O no hydrogen 3.048 N/A ILE 183.A N LEU 179.A O no hydrogen 3.078 N/A ASP 184.A N LYS 180.A O no hydrogen 2.770 N/A ASP 185.A N ALA 181.A O no hydrogen 3.131 N/A ALA 186.A N PHE 182.A O no hydrogen 2.957 N/A VAL 187.A N ILE 183.A O no hydrogen 2.873 N/A ALA 188.A N ASP 184.A O no hydrogen 2.921 N/A ARG 189.A N ASP 185.A O no hydrogen 3.079 N/A ARG 189.A NE ASP 185.A OD1 no hydrogen 2.704 N/A ARG 189.A NH2 ASP 185.A OD2 no hydrogen 3.222 N/A GLY 190.A N VAL 187.A O no hydrogen 2.927 N/A TYR 191.A N ALA 186.A O no hydrogen 2.943 N/A GLU 195.A N.B GLU 195.A OE1.B no hydrogen 2.910 N/A TRP 196.A N ARG 193.A O.A no hydrogen 3.020 N/A TRP 196.A N ARG 193.A O.B no hydrogen 3.018 N/A TYR 197.A N SER 109.A O no hydrogen 2.799 N/A LEU 198.A N ARG 78.A O no hydrogen 2.810 N/A HIS 199.A N TRP 107.A O no hydrogen 2.838 N/A HIS 199.A NE2 SER 109.A OG no hydrogen 3.125 N/A HIS 199.A NE2 VAL 111.A O no hydrogen 2.850 N/A VAL 201.A N PHE 63.A O no hydrogen 2.890 N/A GLU 202.A N ASP 105.A O no hydrogen 2.943 N/A THR 203.A N ILE 61.A O no hydrogen 2.970 N/A GLY 204.A N ALA 103.A O no hydrogen 3.176 N/A PHE 205.A N PRO 59.A O no hydrogen 3.188 N/A GLU 206.A N ASN 101.A OD1 no hydrogen 3.037 N/A LEU 207.A N ALA 57.A O no hydrogen 2.922 N/A TRP 208.A N ARG 99.A O.A no hydrogen 2.926 N/A TRP 208.A N ARG 99.A O.B no hydrogen 2.887 N/A GLU 209.A N ARG 99.A O.A no hydrogen 3.124 N/A GLU 209.A N ARG 99.A O.B no hydrogen 3.124 N/A GLY 210.A N HIS 49.A O no hydrogen 2.995 N/A GLY 213.A N ILE 44.A O no hydrogen 2.807 N/A LEU 214.A N GLY 211.A O no hydrogen 3.222 N/A ARG 215.A N THR 93.A O no hydrogen 3.299 N/A ARG 215.A NH1 THR 43.A OG1 no hydrogen 2.778 N/A SER 216.A N PHE 42.A O no hydrogen 2.812 N/A ALA 217.A N THR 91.A O no hydrogen 2.885 N/A ASP 218.A N ASN 41.A OD1 no hydrogen 3.027 N/A SER 220.A N.A SER 89.A O no hydrogen 3.172 N/A SER 220.A N.B SER 89.A O no hydrogen 3.148 N/A VAL 221.A N TYR 18.A OH no hydrogen 3.072 N/A THR 222.A N ARG 87.A O no hydrogen 2.985 N/A GLN 224.A N.A ASP 85.A O no hydrogen 2.853 N/A GLN 224.A N.B ASP 85.A O no hydrogen 2.844 N/A GLN 224.A NE2.B SER 84.A OG.A no hydrogen 2.832 N/A GLN 224.A NE2.B SER 84.A OG.B no hydrogen 3.022 N/A LEU 226.A N GLU 82.A O no hydrogen 2.937 N/A