Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hbw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N SER 1.A O no hydrogen 2.211 N/A GLY 2.A N VAL 33.A O no hydrogen 3.309 N/A TYR 4.A N LEU 31.A O no hydrogen 2.799 N/A GLN 5.A N LYS 64.A O no hydrogen 2.785 N/A CYS 6.A N ARG 29.A O no hydrogen 2.834 N/A CYS 6.A SG ARG 29.A O no hydrogen 3.528 N/A LEU 7.A N LEU 62.A O no hydrogen 2.798 N/A LEU 10.A N ALA 25.A O no hydrogen 2.898 N/A LEU 12.A N.A THR 23.A O no hydrogen 2.973 N/A LEU 12.A N.B THR 23.A O no hydrogen 2.956 N/A TYR 13.A N TRP 54.A O no hydrogen 2.849 N/A ASP 14.A N SER 20.A O.A no hydrogen 2.952 N/A ASP 14.A N SER 20.A O.B no hydrogen 2.916 N/A SER 15.A OG GLU 17.A OE1 no hydrogen 3.141 N/A CYS 18.A N SER 15.A O no hydrogen 3.022 N/A CYS 18.A SG SER 15.A O no hydrogen 4.000 N/A CYS 18.A SG PRO 16.A O no hydrogen 3.541 N/A SER 20.A OG.A ASP 14.A OD2 no hydrogen 3.198 N/A ALA 22.A N LEU 12.A O.A no hydrogen 2.766 N/A ALA 22.A N LEU 12.A O.B no hydrogen 2.750 N/A THR 23.A N LEU 12.A O.A no hydrogen 3.217 N/A THR 23.A N LEU 12.A O.B no hydrogen 3.164 N/A THR 23.A OG1 THR 105.A OG1 no hydrogen 3.099 N/A GLN 24.A N THR 105.A OG1 no hydrogen 3.253 N/A GLN 24.A NE2 ASN 11.A OD1 no hydrogen 2.902 N/A ALA 25.A N LEU 10.A O no hydrogen 2.758 N/A GLY 28.A N CYS 6.A O no hydrogen 2.847 N/A ARG 29.A N ALA 26.A O no hydrogen 3.068 N/A ARG 29.A NE GLU 48.A OE1 no hydrogen 2.889 N/A ARG 29.A NH2 GLU 48.A OE1 no hydrogen 2.944 N/A ARG 29.A NH2 ASP 49.A OD2 no hydrogen 3.185 N/A HIS 30.A N GLU 48.A OE2 no hydrogen 2.884 N/A HIS 30.A ND1 GLU 3.A OE2 no hydrogen 2.609 N/A LEU 31.A N TYR 4.A O no hydrogen 2.889 N/A GLN 32.A N.A CYS 45.A O no hydrogen 2.877 N/A GLN 32.A N.B CYS 45.A O no hydrogen 2.804 N/A GLN 32.A NE2.A GLU 3.A OE1 no hydrogen 2.774 N/A VAL 33.A N GLY 2.A O no hydrogen 2.963 N/A THR 34.A N GLU 43.A O no hydrogen 3.013 N/A THR 34.A OG1 GLU 43.A O no hydrogen 2.739 N/A ASN 36.A N THR 34.A OG1 no hydrogen 3.037 N/A ASN 36.A ND2 GLU 43.A OE1 no hydrogen 2.862 N/A GLN 38.A N ALA 41.A O no hydrogen 2.961 N/A GLN 38.A NE2 ASN 36.A OD1 no hydrogen 2.908 N/A ALA 41.A N GLN 38.A O no hydrogen 2.990 N/A VAL 42.A N LEU 55.A O no hydrogen 2.873 N/A GLU 43.A N ASN 36.A O no hydrogen 2.919 N/A VAL 44.A N GLY 53.A O no hydrogen 2.845 N/A CYS 45.A N GLN 32.A O.A no hydrogen 2.894 N/A CYS 45.A N GLN 32.A O.B no hydrogen 2.947 N/A CYS 45.A SG LEU 46.A O.A no hydrogen 3.931 N/A CYS 45.A SG LEU 46.A O.B no hydrogen 3.798 N/A CYS 45.A SG ASP 50.A OD1.B no hydrogen 3.054 N/A LEU 46.A N.A TYR 51.A O no hydrogen 2.909 N/A LEU 46.A N.B TYR 51.A O no hydrogen 2.886 N/A CYS 47.A N HIS 30.A O no hydrogen 2.869 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.840 N/A ASP 50.A N.B LEU 46.A O.A no hydrogen 2.837 N/A ASP 50.A N.B LEU 46.A O.B no hydrogen 2.875 N/A TYR 51.A N ASP 49.A OD1 no hydrogen 3.147 N/A TYR 51.A OH ASP 129.A OD1 no hydrogen 3.345 N/A TYR 51.A OH ASP 129.A OD2 no hydrogen 3.247 N/A GLY 53.A N VAL 44.A O no hydrogen 3.021 N/A TRP 54.A N TYR 13.A O no hydrogen 2.876 N/A LEU 55.A N VAL 42.A O no hydrogen 2.866 N/A LEU 57.A N ALA 40.A O no hydrogen 2.995 N/A GLY 58.A N.A SER 56.A OG no hydrogen 3.263 N/A GLY 58.A N.B SER 56.A OG no hydrogen 3.133 N/A ASP 59.A N SER 56.A O no hydrogen 2.954 N/A LEU 60.A N LEU 57.A O no hydrogen 3.193 N/A LEU 62.A N ASP 59.A O no hydrogen 2.876 N/A LEU 63.A N LEU 60.A O no hydrogen 3.305 N/A LYS 64.A N GLN 5.A O no hydrogen 2.903 N/A ALA 66.A N.A GLU 3.A O no hydrogen 2.886 N/A ALA 66.A N.B GLU 3.A O no hydrogen 3.027 N/A TYR 70.A N GLU 3.A OE2 no hydrogen 2.784 N/A GLN 71.A NE2.A LEU 69.A O no hydrogen 3.033 N/A SER 76.A N GLU 79.A OE1 no hydrogen 2.826 N/A SER 76.A OG SER 78.A OG.A no hydrogen 3.169 N/A SER 78.A OG.A SER 76.A OG no hydrogen 3.169 N/A GLU 79.A N SER 76.A OG no hydrogen 3.086 N/A ILE 80.A N SER 76.A O no hydrogen 2.995 N/A LYS 81.A N.A GLU 77.A O no hydrogen 3.051 N/A LYS 81.A N.B GLU 77.A O no hydrogen 3.026 N/A LYS 82.A N SER 78.A O.A no hydrogen 3.404 N/A LYS 82.A N SER 78.A O.B no hydrogen 3.325 N/A LEU 83.A N ILE 80.A O no hydrogen 2.835 N/A LEU 84.A N LYS 81.A O.A no hydrogen 3.346 N/A LEU 84.A N LYS 81.A O.B no hydrogen 3.405 N/A GLY 86.A N LEU 83.A O no hydrogen 3.058 N/A ALA 87.A N LEU 83.A O no hydrogen 3.357 N/A ILE 88.A N LEU 84.A O no hydrogen 3.024 N/A ALA 89.A N PRO 85.A O no hydrogen 2.898 N/A PHE 90.A N GLY 86.A O no hydrogen 2.982 N/A THR 91.A N ALA 87.A O no hydrogen 3.283 N/A THR 91.A OG1 ILE 88.A O no hydrogen 2.738 N/A GLN 92.A N.A ILE 88.A O no hydrogen 3.047 N/A GLN 92.A N.B ILE 88.A O no hydrogen 3.077 N/A LYS 93.A N ALA 89.A O no hydrogen 2.978 N/A ALA 94.A N PHE 90.A O no hydrogen 2.940 N/A GLN 96.A N ALA 94.A O no hydrogen 3.140 N/A ASN 98.A ND2 GLN 96.A O no hydrogen 2.786 N/A TYR 99.A N ASN 109.A OD1 no hydrogen 2.952 N/A TYR 100.A N ASP 182.A OD1 no hydrogen 2.912 N/A LEU 101.A N TYR 110.A O no hydrogen 3.254 N/A GLY 103.A N ASP 111.A OD2 no hydrogen 2.800 N/A GLY 104.A N LEU 101.A O no hydrogen 2.793 N/A THR 105.A N GLN 24.A OE1 no hydrogen 2.882 N/A THR 105.A OG1 THR 23.A OG1 no hydrogen 3.099 N/A THR 105.A OG1 GLY 103.A O no hydrogen 2.766 N/A VAL 106.A N GLN 24.A OE1 no hydrogen 3.267 N/A ASP 111.A N GLY 104.A O no hydrogen 3.136 N/A CYS 112.A N TYR 100.A OH no hydrogen 3.125 N/A CYS 112.A SG TYR 100.A OH no hydrogen 3.557 N/A CYS 112.A SG THR 160.A O no hydrogen 3.981 N/A CYS 112.A SG HIS 161.A ND1 no hydrogen 3.668 N/A SER 113.A OG ASP 111.A OD1 no hydrogen 3.430 N/A SER 113.A OG ARG 128.A O no hydrogen 3.362 N/A GLY 114.A N ASP 111.A OD1 no hydrogen 2.771 N/A LEU 115.A N ASP 111.A O no hydrogen 3.047 N/A GLN 116.A NE2 ASP 49.A OD2 no hydrogen 2.860 N/A GLN 116.A NE2 LEU 126.A O no hydrogen 2.884 N/A ALA 117.A N GLY 114.A O no hydrogen 2.919 N/A ALA 118.A N LEU 115.A O no hydrogen 2.908 N/A VAL 120.A N GLN 116.A O no hydrogen 2.958 N/A SER 121.A N ALA 117.A O no hydrogen 3.094 N/A SER 121.A OG ALA 118.A O no hydrogen 2.727 N/A VAL 122.A N PHE 119.A O no hydrogen 3.020 N/A GLY 123.A N VAL 120.A O no hydrogen 2.887 N/A ILE 124.A N.A PHE 119.A O no hydrogen 2.947 N/A ILE 124.A N.B PHE 119.A O no hydrogen 3.031 N/A TRP 125.A N SER 213.A OG no hydrogen 2.909 N/A ARG 128.A NE THR 23.A OG1 no hydrogen 2.978 N/A ARG 128.A NE THR 105.A OG1 no hydrogen 3.157 N/A ARG 128.A NH1 ASP 111.A OD1 no hydrogen 3.293 N/A ARG 128.A NH1 ARG 128.A O no hydrogen 2.942 N/A ARG 128.A NH2 THR 105.A OG1 no hydrogen 2.944 N/A ARG 128.A NH2 ASP 111.A OD1 no hydrogen 3.016 N/A ARG 128.A NH2 ASP 111.A OD2 no hydrogen 3.137 N/A ASP 129.A N GLN 132.A OE1 no hydrogen 3.108 N/A GLN 133.A N ASP 129.A O no hydrogen 2.884 N/A GLN 133.A NE2 SER 113.A O no hydrogen 3.214 N/A GLN 133.A NE2 PRO 127.A O no hydrogen 2.950 N/A GLU 134.A N.A ALA 130.A O no hydrogen 2.930 N/A GLU 134.A N.B ALA 130.A O no hydrogen 2.899 N/A ALA 135.A N TYR 131.A O no hydrogen 3.081 N/A PHE 136.A N.A GLN 132.A O no hydrogen 2.862 N/A PHE 136.A N.B GLN 132.A O no hydrogen 2.946 N/A THR 137.A N GLN 133.A O no hydrogen 3.050 N/A THR 137.A OG1 GLN 133.A O no hydrogen 2.864 N/A THR 137.A OG1 GLU 134.A O.A no hydrogen 3.490 N/A GLN 138.A N ARG 209.A O no hydrogen 2.925 N/A ILE 140.A N ALA 207.A O no hydrogen 2.970 N/A THR 141.A N GLU 144.A OE1 no hydrogen 3.009 N/A THR 141.A OG1 ASP 143.A OD1.B no hydrogen 2.578 N/A GLU 144.A N THR 141.A O no hydrogen 3.050 N/A LEU 145.A N ILE 142.A O no hydrogen 3.084 N/A ALA 146.A N ASP 149.A OD2 no hydrogen 2.804 N/A GLY 148.A N TYR 165.A O no hydrogen 2.851 N/A ASP 149.A N ALA 146.A O no hydrogen 3.013 N/A LEU 150.A N GLY 208.A O no hydrogen 2.856 N/A VAL 151.A N.A GLY 163.A O no hydrogen 2.874 N/A VAL 151.A N.B GLY 163.A O no hydrogen 2.889 N/A PHE 152.A N GLY 206.A O no hydrogen 2.887 N/A PHE 153.A N HIS 161.A O no hydrogen 3.020 N/A GLY 154.A N GLN 203.A O no hydrogen 2.868 N/A THR 155.A N LYS 158.A O no hydrogen 2.979 N/A THR 155.A OG1 LYS 158.A O no hydrogen 3.392 N/A VAL 157.A N THR 155.A OG1 no hydrogen 2.996 N/A LYS 158.A N THR 155.A OG1 no hydrogen 3.141 N/A THR 160.A N PHE 153.A O no hydrogen 2.828 N/A HIS 161.A N PHE 153.A O no hydrogen 3.061 N/A HIS 161.A NE2 HIS 173.A ND1 no hydrogen 2.677 N/A GLY 163.A N VAL 151.A O.A no hydrogen 2.930 N/A GLY 163.A N VAL 151.A O.B no hydrogen 2.929 N/A LEU 164.A N ILE 172.A O no hydrogen 2.858 N/A TYR 165.A N ASP 149.A O no hydrogen 2.820 N/A LEU 166.A N CYS 170.A O no hydrogen 2.833 N/A GLY 169.A N TYR 165.A OH no hydrogen 2.875 N/A CYS 170.A N GLY 167.A O no hydrogen 2.887 N/A CYS 170.A SG ASP 168.A O no hydrogen 3.848 N/A TYR 171.A N ASP 187.A O no hydrogen 2.903 N/A ILE 172.A N LEU 164.A O no hydrogen 2.940 N/A HIS 173.A N GLY 185.A O no hydrogen 3.055 N/A HIS 173.A ND1 HIS 161.A NE2 no hydrogen 2.677 N/A HIS 173.A NE2 ASP 187.A OD2 no hydrogen 2.707 N/A SER 174.A OG TYR 110.A O no hydrogen 3.224 N/A SER 175.A N GLY 183.A O no hydrogen 3.016 N/A LYS 177.A NZ ASP 182.A OD1 no hydrogen 2.852 N/A GLN 179.A NE2.A GLN 203.A OE1 no hydrogen 3.418 N/A GLN 179.A NE2.B SER 199.A OG.B no hydrogen 3.332 N/A GLN 179.A NE2.B GLN 203.A OE1 no hydrogen 2.218 N/A ARG 181.A N SER 175.A OG no hydrogen 2.900 N/A ARG 181.A NE ASP 187.A OD2 no hydrogen 2.884 N/A ARG 181.A NH2 ASP 187.A OD1 no hydrogen 2.795 N/A ARG 181.A NH2 ASP 194.A OD2.A no hydrogen 3.063 N/A ARG 181.A NH2 ASP 194.A OD2.B no hydrogen 2.876 N/A ASP 182.A N GLY 176.A O no hydrogen 3.167 N/A GLY 183.A N SER 175.A O no hydrogen 2.911 N/A ILE 184.A N ASN 98.A OD1 no hydrogen 2.936 N/A GLY 185.A N HIS 173.A O no hydrogen 2.943 N/A ASP 187.A N TYR 171.A O no hydrogen 2.967 N/A ILE 188.A N.A SER 197.A OG no hydrogen 2.996 N/A ILE 188.A N.B SER 197.A OG no hydrogen 2.977 N/A LEU 189.A N GLY 169.A O no hydrogen 2.842 N/A SER 190.A N ILE 188.A O.B no hydrogen 2.809 N/A SER 190.A OG GLN 192.A OE1.B no hydrogen 3.133 N/A GLN 192.A N.A SER 190.A OG no hydrogen 3.011 N/A GLN 192.A N.B SER 190.A OG no hydrogen 2.768 N/A GLY 193.A N SER 190.A O no hydrogen 3.179 N/A SER 197.A N ASP 194.A OD1.A no hydrogen 3.029 N/A SER 197.A N ASP 194.A OD1.B no hydrogen 2.886 N/A SER 197.A OG ASP 187.A OD1 no hydrogen 2.605 N/A SER 197.A OG ASP 194.A OD1.A no hydrogen 3.547 N/A ARG 198.A N ASP 194.A O.A no hydrogen 2.854 N/A ARG 198.A N ASP 194.A O.B no hydrogen 2.905 N/A ARG 198.A NH1 GLY 193.A O no hydrogen 2.807 N/A SER 199.A N.A VAL 195.A O.A no hydrogen 2.959 N/A SER 199.A N.A VAL 195.A O.B no hydrogen 2.893 N/A SER 199.A N.B VAL 195.A O.A no hydrogen 2.966 N/A SER 199.A N.B VAL 195.A O.B no hydrogen 2.898 N/A SER 199.A N.C VAL 195.A O.A no hydrogen 2.964 N/A SER 199.A N.C VAL 195.A O.B no hydrogen 2.895 N/A SER 199.A OG.A VAL 195.A O.A no hydrogen 3.161 N/A SER 199.A OG.A VAL 195.A O.B no hydrogen 3.392 N/A SER 199.A OG.B GLN 179.A O.A no hydrogen 3.270 N/A SER 199.A OG.B GLN 179.A O.B no hydrogen 3.517 N/A SER 199.A OG.B VAL 195.A O.A no hydrogen 3.518 N/A SER 199.A OG.B VAL 196.A O no hydrogen 2.648 N/A TYR 200.A N VAL 196.A O no hydrogen 3.111 N/A TYR 201.A N SER 197.A O no hydrogen 2.848 N/A GLN 202.A N ARG 198.A O no hydrogen 3.053 N/A GLN 202.A NE2 GLU 191.A OE1.A no hydrogen 2.787 N/A GLN 203.A N TYR 200.A O no hydrogen 2.899 N/A LEU 204.A N TYR 201.A O no hydrogen 3.125 N/A ARG 205.A N.A PHE 152.A O no hydrogen 2.809 N/A ARG 205.A N.B PHE 152.A O no hydrogen 2.796 N/A ARG 205.A NE.A THR 155.A O no hydrogen 2.943 N/A ARG 205.A NE.B GLU 134.A OE1.A no hydrogen 3.254 N/A ARG 205.A NE.B GLU 134.A OE2.B no hydrogen 2.878 N/A ARG 205.A NH1.A GLU 134.A OE2.B no hydrogen 2.572 N/A ARG 205.A NH1.B THR 155.A O no hydrogen 2.744 N/A ARG 205.A NH1.B PRO 156.A O.A no hydrogen 3.181 N/A ARG 205.A NH2.A PRO 156.A O.A no hydrogen 3.116 N/A ARG 205.A NH2.B GLU 134.A OE1.A no hydrogen 3.478 N/A ARG 205.A NH2.B GLU 134.A OE1.B no hydrogen 2.861 N/A ARG 205.A NH2.B GLU 134.A OE2.B no hydrogen 3.311 N/A GLY 206.A N PHE 152.A O no hydrogen 3.192 N/A GLY 208.A N LEU 150.A O no hydrogen 2.871 N/A ARG 209.A N GLN 138.A O no hydrogen 2.849 N/A ARG 209.A NE ASP 149.A OD1 no hydrogen 2.939 N/A ARG 209.A NE ASP 149.A OD2 no hydrogen 3.417 N/A ARG 209.A NH2 ASP 149.A OD2 no hydrogen 2.809 N/A TYR 214.A N TRP 125.A O no hydrogen 2.807 N/A ARG 218.A NH2 TYR 70.A O no hydrogen 3.165 N/A ARG 218.A NH2 GLN 71.A OE1.A no hydrogen 3.212 N/A ARG 218.A NH2 GLN 71.A OE1.B no hydrogen 2.657 N/A