Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wwo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG GLY 29.A O no hydrogen 2.797 N/A ALA 3.A N HIS 30.A ND1 no hydrogen 3.074 N/A HIS 4.A NE2 THR 33.A OG1 no hydrogen 2.898 N/A PHE 5.A N ASN 31.A O no hydrogen 2.691 N/A ILE 6.A N ILE 74.A O no hydrogen 2.839 N/A LEU 7.A N THR 33.A O no hydrogen 2.848 N/A ILE 8.A N VAL 76.A O no hydrogen 2.781 N/A THR 10.A N GLU 78.A OE2 no hydrogen 2.742 N/A THR 10.A OG1 GLU 78.A OE2 no hydrogen 2.582 N/A CYS 12.A SG VAL 145.A O no hydrogen 3.617 N/A HIS 13.A N THR 10.A O no hydrogen 3.203 N/A HIS 13.A ND1 ILE 11.A O no hydrogen 3.057 N/A ALA 15.A N ASP 36.A OD1 no hydrogen 2.714 N/A LEU 17.A N GLY 14.A O no hydrogen 3.118 N/A TRP 18.A N ALA 15.A O no hydrogen 3.006 N/A TYR 19.A N TRP 16.A O no hydrogen 3.108 N/A TYR 19.A OH ASP 164.A OD1 no hydrogen 2.599 N/A LYS 20.A NZ ASP 164.A OD2 no hydrogen 2.683 N/A LYS 20.A NZ ILE 238.A O no hydrogen 2.893 N/A LEU 21.A N TRP 18.A O no hydrogen 2.928 N/A ILE 22.A N TRP 18.A O no hydrogen 3.181 N/A LEU 25.A N LEU 21.A O no hydrogen 2.978 N/A GLN 26.A N ILE 22.A O no hydrogen 3.008 N/A SER 27.A N PRO 23.A O no hydrogen 2.899 N/A SER 27.A OG PRO 23.A O no hydrogen 3.245 N/A ALA 28.A N LEU 24.A O no hydrogen 3.333 N/A ALA 28.A N LEU 25.A O no hydrogen 3.203 N/A GLY 29.A N GLN 26.A O no hydrogen 2.938 N/A HIS 30.A N LEU 25.A O no hydrogen 3.085 N/A HIS 30.A NE2 GLN 249.A OE1 no hydrogen 2.804 N/A ASN 31.A N ALA 3.A O no hydrogen 2.790 N/A THR 33.A N PHE 5.A O no hydrogen 2.890 N/A THR 33.A OG1 HIS 4.A NE2 no hydrogen 2.898 N/A VAL 38.A N TYR 56.A O no hydrogen 3.421 N/A ALA 39.A N ASP 43.A OD2 no hydrogen 2.979 N/A SER 40.A N LEU 37.A O no hydrogen 3.037 N/A SER 40.A OG VAL 38.A O no hydrogen 2.965 N/A ILE 42.A N ASP 36.A OD2 no hydrogen 2.929 N/A ASP 43.A N SER 40.A O no hydrogen 2.961 N/A ARG 45.A N ASP 43.A OD2 no hydrogen 3.047 N/A ARG 45.A NE ASP 43.A OD2 no hydrogen 2.866 N/A ARG 45.A NH2 ASP 43.A OD1 no hydrogen 2.683 N/A GLN 46.A N GLN 49.A OE1 no hydrogen 2.928 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.683 N/A GLN 49.A N GLN 46.A O no hydrogen 3.081 N/A ILE 50.A N LEU 47.A O no hydrogen 2.967 N/A GLY 51.A N GLN 55.A OE1 no hydrogen 2.881 N/A TRP 53.A N ASP 181.A OD2 no hydrogen 2.972 N/A TRP 53.A NE1 PHE 177.A O no hydrogen 2.712 N/A GLN 55.A N THR 52.A OG1 no hydrogen 3.311 N/A GLN 55.A NE2 TYR 137.A OH no hydrogen 3.382 N/A TYR 56.A N THR 52.A O no hydrogen 2.868 N/A SER 57.A N TRP 53.A O no hydrogen 2.840 N/A SER 57.A OG TRP 53.A O no hydrogen 2.639 N/A SER 57.A OG ASN 84.A OD1 no hydrogen 3.146 N/A GLU 58.A N GLN 55.A O no hydrogen 3.288 N/A LEU 60.A N SER 57.A O no hydrogen 2.759 N/A PHE 61.A N SER 57.A O no hydrogen 3.112 N/A THR 62.A N GLU 58.A O no hydrogen 2.716 N/A THR 62.A OG1 GLU 58.A O no hydrogen 3.063 N/A THR 62.A OG1 GLU 58.A OE2 no hydrogen 2.450 N/A LEU 63.A N PRO 59.A O no hydrogen 3.156 N/A ILE 64.A N LEU 60.A O no hydrogen 3.052 N/A GLU 65.A N PHE 61.A O no hydrogen 2.900 N/A SER 66.A N LEU 63.A O no hydrogen 3.115 N/A SER 66.A OG LEU 63.A O no hydrogen 2.834 N/A ILE 67.A N ILE 64.A O no hydrogen 3.173 N/A LYS 71.A N PRO 68.A O no hydrogen 3.149 N/A VAL 73.A N LYS 95.A O no hydrogen 2.728 N/A ILE 74.A N HIS 4.A O no hydrogen 2.914 N/A LEU 75.A N ALA 98.A O no hydrogen 3.006 N/A VAL 76.A N ILE 6.A O no hydrogen 2.880 N/A GLY 77.A N VAL 100.A O no hydrogen 2.906 N/A GLU 78.A N ILE 8.A O no hydrogen 3.223 N/A SER 79.A N HIS 102.A O no hydrogen 2.996 N/A SER 79.A OG HIS 234.A NE2 no hydrogen 2.812 N/A GLY 81.A N GLU 78.A O no hydrogen 2.668 N/A GLY 82.A N SER 79.A O no hydrogen 3.095 N/A ILE 83.A N GLY 80.A O no hydrogen 3.177 N/A ILE 85.A N GLY 81.A O no hydrogen 3.179 N/A ALA 86.A N GLY 82.A O no hydrogen 3.043 N/A LEU 87.A N ILE 83.A O no hydrogen 2.981 N/A ALA 88.A N ASN 84.A O no hydrogen 3.058 N/A ALA 89.A N ILE 85.A O no hydrogen 2.973 N/A GLU 90.A N ALA 86.A O no hydrogen 3.059 N/A LYS 91.A N LEU 87.A O no hydrogen 2.984 N/A TYR 92.A N ALA 88.A O no hydrogen 2.722 N/A TYR 92.A OH GLU 65.A OE2 no hydrogen 3.053 N/A LYS 95.A N TYR 92.A O no hydrogen 2.921 N/A LYS 95.A NZ ILE 64.A O no hydrogen 3.400 N/A LYS 95.A NZ ILE 67.A O no hydrogen 2.867 N/A VAL 96.A N PRO 93.A O no hydrogen 3.491 N/A SER 97.A N VAL 73.A O no hydrogen 2.978 N/A SER 97.A OG VAL 73.A O no hydrogen 3.246 N/A LEU 99.A N ARG 197.A O no hydrogen 2.801 N/A VAL 100.A N LEU 75.A O no hydrogen 2.769 N/A PHE 101.A N VAL 199.A O no hydrogen 2.800 N/A HIS 102.A N GLY 77.A O no hydrogen 2.927 N/A ASN 103.A N VAL 201.A O no hydrogen 2.968 N/A ASN 103.A ND2 ASP 233.A O no hydrogen 3.033 N/A ASN 103.A ND2 HIS 234.A O no hydrogen 2.821 N/A LEU 105.A N SER 79.A O no hydrogen 3.135 N/A MET 106.A N GLN 217.A OE1 no hydrogen 2.930 N/A HIS 111.A N ASP 108.A OD1 no hydrogen 2.912 N/A HIS 111.A ND1 ASP 108.A OD2 no hydrogen 2.831 N/A SER 112.A OG ASP 183.A OD1 no hydrogen 3.413 N/A PHE 115.A N SER 112.A O no hydrogen 2.923 N/A LYS 118.A N ALA 114.A O no hydrogen 2.811 N/A LYS 118.A NZ ASP 183.A OD1 no hydrogen 2.867 N/A LYS 119.A N PHE 115.A O no hydrogen 3.035 N/A LYS 119.A NZ GLU 122.A OE1 no hydrogen 3.257 N/A PHE 120.A N VAL 116.A O no hydrogen 3.295 N/A SER 121.A N TYR 117.A O no hydrogen 2.966 N/A SER 121.A OG TYR 117.A O no hydrogen 2.992 N/A GLU 122.A N LYS 118.A O no hydrogen 2.973 N/A VAL 123.A N LYS 119.A O no hydrogen 3.111 N/A VAL 123.A N PHE 120.A O no hydrogen 3.157 N/A PHE 124.A N PHE 120.A O no hydrogen 2.879 N/A TRP 127.A N THR 125.A O no hydrogen 3.099 N/A LYS 128.A NZ GLU 154.A OE1 no hydrogen 2.891 N/A LYS 128.A NZ ASN 155.A OD1 no hydrogen 2.744 N/A SER 130.A N TRP 127.A O no hydrogen 2.948 N/A SER 130.A OG TRP 127.A O no hydrogen 3.316 N/A SER 130.A OG THR 151.A OG1 no hydrogen 2.771 N/A ILE 131.A N GLU 146.A O no hydrogen 2.880 N/A SER 133.A N ALA 144.A O no hydrogen 3.064 N/A TYR 135.A N VAL 142.A O no hydrogen 2.931 N/A TYR 135.A OH ILE 50.A O no hydrogen 2.826 N/A TYR 137.A N ASP 140.A O no hydrogen 2.901 N/A ASP 140.A N TYR 137.A O no hydrogen 3.053 N/A VAL 142.A N TYR 135.A O no hydrogen 2.653 N/A ALA 144.A N SER 133.A O no hydrogen 2.724 N/A VAL 145.A N GLY 175.A O no hydrogen 2.649 N/A GLU 146.A N ILE 131.A O no hydrogen 2.880 N/A GLY 148.A N SER 130.A OG no hydrogen 2.939 N/A ARG 150.A N ASP 129.A OD2 no hydrogen 2.952 N/A ARG 150.A NE GLU 154.A OE2 no hydrogen 2.866 N/A ARG 150.A NH2 GLU 154.A OE2 no hydrogen 3.423 N/A THR 151.A N ASP 129.A OD1 no hydrogen 3.352 N/A THR 151.A OG1 ASP 129.A OD1 no hydrogen 3.520 N/A THR 151.A OG1 SER 130.A OG no hydrogen 2.771 N/A LEU 152.A N GLY 148.A O no hydrogen 2.842 N/A ALA 153.A N ASP 149.A O no hydrogen 2.839 N/A GLU 154.A N ARG 150.A O no hydrogen 2.625 N/A ASN 155.A N THR 151.A O no hydrogen 3.012 N/A ASN 155.A ND2 GLN 207.A O no hydrogen 2.845 N/A ILE 156.A N THR 151.A O no hydrogen 3.133 N/A PHE 157.A N LEU 152.A O no hydrogen 2.781 N/A ASN 159.A N ASP 233.A OD2 no hydrogen 2.876 N/A ASN 159.A ND2 SER 231.A O no hydrogen 2.652 N/A SER 160.A N PHE 157.A O no hydrogen 3.178 N/A SER 160.A OG ASP 233.A OD2 no hydrogen 2.705 N/A ASP 164.A N PRO 161.A O no hydrogen 2.890 N/A VAL 165.A N PRO 161.A O no hydrogen 3.348 N/A GLU 166.A N ILE 162.A O no hydrogen 2.849 N/A LEU 167.A N GLU 163.A O no hydrogen 2.894 N/A ALA 168.A N ASP 164.A O no hydrogen 2.967 N/A LYS 169.A N VAL 165.A O no hydrogen 3.053 N/A LYS 169.A NZ GLU 166.A OE1 no hydrogen 3.146 N/A HIS 170.A N GLU 166.A O no hydrogen 3.317 N/A HIS 170.A N LEU 167.A O no hydrogen 3.115 N/A HIS 170.A ND1 GLU 166.A O no hydrogen 2.847 N/A LEU 171.A N ALA 168.A O no hydrogen 3.081 N/A VAL 172.A N ALA 168.A O no hydrogen 2.853 N/A ARG 173.A N CYS 12.A O no hydrogen 3.043 N/A ARG 173.A NH1 GLY 41.A O no hydrogen 2.883 N/A ARG 173.A NH1 ASP 43.A O no hydrogen 2.838 N/A ARG 173.A NH2 ARG 45.A O no hydrogen 2.738 N/A LYS 174.A NZ GLU 48.A OE2 no hydrogen 2.609 N/A GLY 175.A N VAL 145.A O no hydrogen 2.800 N/A SER 176.A OG THR 143.A O no hydrogen 2.740 N/A PHE 178.A N SER 176.A OG no hydrogen 3.064 N/A LEU 182.A N PHE 178.A O no hydrogen 2.948 N/A ASP 183.A N GLU 179.A O no hydrogen 2.875 N/A THR 184.A N ASP 181.A O no hydrogen 3.000 N/A LEU 185.A N LEU 182.A O no hydrogen 3.065 N/A ASN 187.A ND2 ILE 109.A O no hydrogen 3.138 N/A THR 189.A N GLU 90.A OE1 no hydrogen 3.164 N/A THR 189.A OG1 GLU 90.A OE2 no hydrogen 2.677 N/A GLY 192.A N THR 189.A O no hydrogen 3.336 N/A GLY 192.A N THR 189.A OG1 no hydrogen 3.260 N/A TYR 193.A N GLU 90.A OE1 no hydrogen 2.786 N/A TYR 193.A OH PRO 107.A O no hydrogen 2.830 N/A GLY 194.A N THR 189.A O no hydrogen 2.915 N/A SER 195.A N GLY 192.A O no hydrogen 2.782 N/A SER 195.A OG GLU 191.A O no hydrogen 3.421 N/A SER 195.A OG GLY 192.A O no hydrogen 2.905 N/A ARG 198.A N ASP 224.A OD2 no hydrogen 3.030 N/A ARG 198.A NH1 LYS 222.A O no hydrogen 3.262 N/A ARG 198.A NH2 TYR 221.A O no hydrogen 2.422 N/A VAL 199.A N LEU 99.A O no hydrogen 2.773 N/A TYR 200.A N LYS 225.A O no hydrogen 2.890 N/A TYR 200.A OH GLN 214.A OE1 no hydrogen 2.688 N/A VAL 201.A N PHE 101.A O no hydrogen 2.770 N/A TYR 202.A N TYR 227.A O no hydrogen 2.858 N/A GLY 203.A N ASN 103.A OD1 no hydrogen 2.805 N/A GLU 204.A N VAL 229.A O no hydrogen 3.107 N/A GLU 205.A N ALA 232.A O no hydrogen 2.703 N/A ASP 206.A N GLY 203.A O no hydrogen 3.071 N/A ILE 208.A N ASP 206.A OD1 no hydrogen 2.959 N/A PHE 209.A N ASP 206.A OD1 no hydrogen 2.812 N/A ARG 211.A NH1 GLU 204.A O no hydrogen 3.477 N/A GLN 214.A N SER 210.A O no hydrogen 2.954 N/A GLN 214.A NE2 ASN 103.A OD1 no hydrogen 2.978 N/A GLN 214.A NE2 PHE 209.A O no hydrogen 3.298 N/A LEU 215.A N ARG 211.A O no hydrogen 2.872 N/A TRP 216.A N ASP 212.A O no hydrogen 2.921 N/A GLN 217.A N PHE 213.A O no hydrogen 2.956 N/A GLN 217.A NE2 ALA 104.A O no hydrogen 2.952 N/A GLN 217.A NE2 TYR 200.A OH no hydrogen 2.816 N/A ILE 218.A N GLN 214.A O no hydrogen 3.003 N/A ASN 219.A N LEU 215.A O no hydrogen 2.901 N/A ASN 220.A N TRP 216.A O no hydrogen 2.829 N/A ASN 220.A ND2 ASP 108.A OD2 no hydrogen 2.932 N/A TYR 221.A N GLN 217.A O no hydrogen 3.340 N/A ASP 224.A N ARG 198.A O no hydrogen 2.893 N/A TYR 227.A N TYR 200.A O no hydrogen 2.797 N/A TYR 227.A OH GLU 250.A OE2 no hydrogen 2.746 N/A VAL 229.A N TYR 202.A O no hydrogen 2.811 N/A SER 231.A N GLU 204.A OE1 no hydrogen 3.368 N/A ALA 232.A N VAL 229.A O no hydrogen 3.308 N/A ASP 233.A N SER 239.A OG no hydrogen 3.381 N/A HIS 234.A ND1 ASP 206.A OD2 no hydrogen 2.669 N/A HIS 234.A NE2 SER 79.A OG no hydrogen 2.812 N/A LYS 235.A N ASP 233.A OD1 no hydrogen 2.979 N/A LYS 235.A NZ GLU 78.A OE1 no hydrogen 2.844 N/A LYS 235.A NZ GLU 78.A OE2 no hydrogen 3.141 N/A GLN 237.A N HIS 102.A NE2 no hydrogen 3.161 N/A GLN 237.A NE2 GLU 78.A OE1 no hydrogen 3.131 N/A ILE 238.A N LYS 235.A O no hydrogen 2.765 N/A SER 239.A N LYS 235.A O no hydrogen 2.961 N/A SER 239.A OG ASP 233.A OD1 no hydrogen 2.609 N/A SER 239.A OG LYS 235.A O no hydrogen 3.117 N/A LYS 240.A N ILE 236.A O no hydrogen 2.824 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.473 N/A LEU 244.A N LYS 240.A O no hydrogen 3.121 N/A ALA 245.A N VAL 241.A O no hydrogen 2.653 N/A GLN 246.A N ASN 242.A O no hydrogen 2.820 N/A ILE 247.A N GLU 243.A O no hydrogen 2.887 N/A LEU 248.A N LEU 244.A O no hydrogen 2.962 N/A GLN 249.A N ALA 245.A O no hydrogen 2.927 N/A GLN 249.A NE2 ASN 253.A OD1 no hydrogen 3.206 N/A GLU 250.A N GLN 246.A O no hydrogen 3.276 N/A VAL 251.A N ILE 247.A O no hydrogen 3.119 N/A ALA 252.A N LEU 248.A O no hydrogen 2.979 N/A ASN 253.A N GLN 249.A O no hydrogen 2.900 N/A SER 254.A N GLU 250.A O no hydrogen 2.782 N/A ALA 255.A N VAL 251.A O no hydrogen 2.850 N/A ALA 255.A N ALA 252.A O no hydrogen 3.056 N/A SER 256.A N ASN 253.A O no hydrogen 3.215 N/A