Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wo4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N CYS 96.A O no hydrogen 2.982 N/A ARG 5.A N TRP 25.A O no hydrogen 2.879 N/A CYS 6.A N ALA 94.A O no hydrogen 2.675 N/A LEU 7.A N LEU 23.A O no hydrogen 2.794 N/A GLN 8.A N VAL 92.A O no hydrogen 2.987 N/A GLN 8.A NE2 SER 10.A OG no hydrogen 2.957 N/A ILE 9.A N ASP 21.A O no hydrogen 2.853 N/A SER 10.A N LEU 90.A O no hydrogen 2.806 N/A SER 10.A OG THR 20.A OG1 no hydrogen 2.709 N/A SER 11.A N ARG 19.A O no hydrogen 2.789 N/A SER 11.A OG GLU 89.A OE2 no hydrogen 2.605 N/A PHE 12.A N LEU 88.A O no hydrogen 2.805 N/A ALA 13.A N TRP 17.A O no hydrogen 2.932 N/A SER 16.A N ASN 14.A OD1 no hydrogen 2.984 N/A SER 16.A OG ASN 14.A OD1 no hydrogen 2.934 N/A THR 18.A OG1 SER 11.A O no hydrogen 3.094 N/A ARG 19.A N SER 11.A O no hydrogen 2.889 N/A ARG 19.A NH1 ASP 37.A OD2 no hydrogen 3.491 N/A ARG 19.A NH2 ASP 21.A OD1 no hydrogen 3.324 N/A ARG 19.A NH2 ASP 37.A OD2 no hydrogen 3.095 N/A THR 20.A N ASN 36.A OD1 no hydrogen 2.934 N/A THR 20.A OG1 SER 10.A OG no hydrogen 2.709 N/A ASP 21.A N ILE 9.A O no hydrogen 3.011 N/A GLY 22.A N TRP 34.A O no hydrogen 2.934 N/A LEU 23.A N LEU 7.A O no hydrogen 2.957 N/A ALA 24.A N HIS 32.A O no hydrogen 3.098 N/A TRP 25.A N ARG 5.A O no hydrogen 2.837 N/A LEU 26.A N LEU 29.A O no hydrogen 2.760 N/A GLY 27.A N PRO 3.A O no hydrogen 3.000 N/A LEU 29.A N LEU 26.A O no hydrogen 3.052 N/A GLN 30.A NE2 HIS 32.A O no hydrogen 3.215 N/A THR 31.A N ALA 24.A O no hydrogen 2.975 N/A THR 31.A OG1 ALA 24.A O no hydrogen 3.543 N/A THR 31.A OG1 HIS 32.A ND1 no hydrogen 2.655 N/A HIS 32.A NE2 SER 48.A O no hydrogen 2.713 N/A SER 33.A N ARG 42.A O no hydrogen 3.111 N/A TRP 34.A N GLY 22.A O no hydrogen 2.956 N/A TRP 34.A NE1 SER 38.A O no hydrogen 3.084 N/A ASN 36.A N ASP 21.A OD1 no hydrogen 3.033 N/A SER 38.A N SER 35.A O no hydrogen 3.245 N/A SER 38.A OG THR 40.A O no hydrogen 2.597 N/A THR 40.A N SER 38.A OG no hydrogen 3.147 N/A THR 40.A OG1 VAL 41.A O no hydrogen 3.181 N/A THR 40.A OG1 GLN 61.A OE1 no hydrogen 3.111 N/A VAL 41.A N GLN 61.A OE1 no hydrogen 2.975 N/A ARG 42.A N SER 33.A O no hydrogen 2.980 N/A ARG 42.A NE SER 33.A OG no hydrogen 3.418 N/A LEU 44.A N THR 31.A O no hydrogen 2.933 N/A LYS 45.A N SER 48.A OG no hydrogen 2.940 N/A LYS 45.A NZ GLN 30.A O no hydrogen 3.492 N/A LYS 45.A NZ GLU 235.A OE1 no hydrogen 3.093 N/A LYS 45.A NZ GLU 235.A OE2 no hydrogen 3.399 N/A TRP 47.A NE1 GLU 174.A OE1 no hydrogen 3.019 N/A SER 48.A N LYS 45.A O no hydrogen 3.350 N/A SER 48.A OG THR 31.A O no hydrogen 2.730 N/A SER 48.A OG LYS 45.A O no hydrogen 3.168 N/A GLN 49.A NE2 PHE 52.A O no hydrogen 2.587 N/A GLN 49.A NE2 ASP 54.A OD1 no hydrogen 3.427 N/A GLY 50.A N TRP 47.A O no hydrogen 2.941 N/A PHE 52.A N GLN 49.A O no hydrogen 3.330 N/A SER 53.A N GLN 56.A OE1 no hydrogen 3.127 N/A SER 53.A OG GLN 56.A OE1 no hydrogen 3.417 N/A GLN 56.A N SER 53.A OG no hydrogen 3.059 N/A TRP 57.A N SER 53.A O no hydrogen 3.020 N/A GLU 58.A N ASP 54.A O no hydrogen 3.128 N/A THR 59.A N GLN 55.A O no hydrogen 3.116 N/A THR 59.A OG1 GLN 55.A O no hydrogen 3.209 N/A LEU 60.A N GLN 56.A O no hydrogen 3.152 N/A GLN 61.A N TRP 57.A O no hydrogen 3.224 N/A GLN 61.A NE2 TRP 57.A O no hydrogen 3.479 N/A HIS 62.A N GLU 58.A O no hydrogen 2.928 N/A ILE 63.A N THR 59.A O no hydrogen 2.971 N/A PHE 64.A N LEU 60.A O no hydrogen 3.122 N/A ARG 65.A N GLN 61.A O no hydrogen 3.061 N/A ARG 65.A NE ASP 39.A O no hydrogen 2.599 N/A ARG 65.A NH1 GLU 58.A OE1 no hydrogen 3.107 N/A ARG 65.A NH2 ASP 39.A O no hydrogen 3.126 N/A ARG 65.A NH2 GLU 58.A OE1 no hydrogen 3.254 N/A VAL 66.A N HIS 62.A O no hydrogen 2.972 N/A TYR 67.A N ILE 63.A O no hydrogen 2.881 N/A TYR 67.A OH GLN 8.A OE1 no hydrogen 2.718 N/A ARG 68.A N PHE 64.A O no hydrogen 2.763 N/A ARG 68.A NH1 SER 35.A O no hydrogen 3.097 N/A ARG 68.A NH1 SER 38.A O no hydrogen 3.250 N/A ARG 68.A NH2 SER 38.A O no hydrogen 2.746 N/A SER 69.A N ARG 65.A O no hydrogen 3.365 N/A SER 69.A OG ARG 65.A O no hydrogen 3.377 N/A SER 70.A N VAL 66.A O no hydrogen 3.020 N/A SER 70.A OG VAL 66.A O no hydrogen 2.687 N/A PHE 71.A N TYR 67.A O no hydrogen 2.705 N/A THR 72.A N ARG 68.A O no hydrogen 3.322 N/A THR 72.A OG1 ARG 68.A O no hydrogen 2.805 N/A ARG 73.A N SER 69.A O no hydrogen 3.082 N/A ASP 74.A N SER 70.A O no hydrogen 3.054 N/A VAL 75.A N PHE 71.A O no hydrogen 3.011 N/A LYS 76.A N THR 72.A O no hydrogen 3.137 N/A LYS 76.A NZ SER 15.A O no hydrogen 3.451 N/A GLU 77.A N ARG 73.A O no hydrogen 2.987 N/A PHE 78.A N ASP 74.A O no hydrogen 2.849 N/A ALA 79.A N VAL 75.A O no hydrogen 2.821 N/A LYS 80.A N LYS 76.A O no hydrogen 3.040 N/A MET 81.A N GLU 77.A O no hydrogen 3.085 N/A LEU 82.A N PHE 78.A O no hydrogen 2.813 N/A LEU 84.A N ALA 79.A O no hydrogen 2.987 N/A LEU 88.A N PHE 12.A O no hydrogen 2.850 N/A GLU 89.A N GLN 113.A OE1 no hydrogen 3.050 N/A LEU 90.A N SER 10.A O no hydrogen 2.893 N/A GLN 91.A N ALA 111.A O no hydrogen 3.097 N/A VAL 92.A N GLN 8.A O no hydrogen 3.068 N/A SER 93.A N HIS 109.A O no hydrogen 2.828 N/A ALA 94.A N CYS 6.A O no hydrogen 2.994 N/A GLY 95.A N PHE 107.A O no hydrogen 2.988 N/A CYS 96.A N LEU 4.A O no hydrogen 3.299 N/A GLU 97.A N ASN 105.A O no hydrogen 2.830 N/A HIS 99.A NE2 GLU 97.A OE2 no hydrogen 2.789 N/A SER 104.A OG GLU 97.A O no hydrogen 3.393 N/A ASN 105.A N GLU 97.A O no hydrogen 3.258 N/A ASN 106.A ND2 ASN 157.A OD1 no hydrogen 3.407 N/A PHE 107.A N GLY 95.A O no hydrogen 3.011 N/A HIS 109.A N SER 93.A O no hydrogen 2.739 N/A VAL 110.A N LEU 118.A O no hydrogen 3.032 N/A ALA 111.A N GLN 91.A O no hydrogen 2.739 N/A PHE 112.A N LYS 115.A O no hydrogen 2.794 N/A GLN 113.A N GLU 89.A O no hydrogen 2.953 N/A GLN 113.A NE2 PRO 87.A O no hydrogen 3.020 N/A LYS 115.A N PHE 112.A O no hydrogen 3.213 N/A ILE 117.A N VAL 110.A O no hydrogen 3.114 N/A SER 119.A N GLU 126.A O no hydrogen 2.904 N/A PHE 120.A N PHE 108.A O no hydrogen 3.063 N/A GLN 121.A N SER 124.A O no hydrogen 2.839 N/A GLN 121.A NE2 SER 119.A OG no hydrogen 2.687 N/A TRP 125.A N ASN 143.A OD1 no hydrogen 2.993 N/A GLU 126.A N SER 119.A O no hydrogen 2.827 N/A THR 128.A N ILE 117.A O no hydrogen 2.945 N/A VAL 135.A N PRO 132.A O no hydrogen 3.081 N/A ASN 136.A N LEU 133.A O no hydrogen 3.338 N/A ALA 138.A N TRP 134.A O no hydrogen 3.034 N/A ILE 139.A N VAL 135.A O no hydrogen 2.901 N/A GLN 140.A N ASN 136.A O no hydrogen 3.299 N/A VAL 141.A N LEU 137.A O no hydrogen 3.499 N/A LEU 142.A N ALA 138.A O no hydrogen 2.942 N/A ASN 143.A N ILE 139.A O no hydrogen 2.824 N/A ASN 143.A ND2 TRP 125.A O no hydrogen 3.125 N/A GLN 144.A N GLN 140.A O no hydrogen 3.261 N/A GLN 144.A N VAL 141.A O no hydrogen 3.102 N/A ASP 145.A N LEU 142.A O no hydrogen 3.051 N/A THR 148.A N ASP 145.A OD1 no hydrogen 3.360 N/A THR 148.A OG1 ASP 145.A OD2 no hydrogen 2.571 N/A ARG 149.A N ASP 145.A O no hydrogen 3.238 N/A ARG 149.A NE ASN 143.A O no hydrogen 2.857 N/A ARG 149.A NH1 THR 123.A O no hydrogen 2.752 N/A ARG 149.A NH2 ASN 143.A O no hydrogen 3.104 N/A GLU 150.A N LYS 146.A O no hydrogen 2.995 N/A THR 151.A N TRP 147.A O no hydrogen 3.069 N/A THR 151.A OG1 TRP 147.A O no hydrogen 2.795 N/A VAL 152.A N THR 148.A O no hydrogen 2.851 N/A GLN 153.A N ARG 149.A O no hydrogen 3.047 N/A TRP 154.A N GLU 150.A O no hydrogen 3.001 N/A LEU 155.A N THR 151.A O no hydrogen 2.995 N/A LEU 156.A N VAL 152.A O no hydrogen 2.920 N/A ASN 157.A N GLN 153.A O no hydrogen 2.794 N/A GLY 158.A N TRP 154.A O no hydrogen 2.982 N/A THR 159.A N TRP 154.A O no hydrogen 2.922 N/A THR 159.A OG1 TRP 154.A O no hydrogen 3.233 N/A CYS 160.A N LEU 155.A O no hydrogen 2.647 N/A PHE 163.A N THR 159.A O no hydrogen 2.786 N/A VAL 164.A N CYS 160.A O no hydrogen 2.894 N/A SER 165.A N PRO 161.A O no hydrogen 2.960 N/A SER 165.A OG PRO 161.A O no hydrogen 2.912 N/A GLY 166.A N GLN 162.A O no hydrogen 3.473 N/A LEU 167.A N PHE 163.A O no hydrogen 3.054 N/A LEU 168.A N VAL 164.A O no hydrogen 2.954 N/A GLU 169.A N SER 165.A O no hydrogen 3.170 N/A GLU 169.A N GLY 166.A O no hydrogen 3.141 N/A SER 170.A N GLY 166.A O no hydrogen 2.856 N/A SER 170.A OG TRP 47.A O no hydrogen 3.034 N/A SER 170.A OG GLY 166.A O no hydrogen 3.176 N/A SER 170.A OG LEU 167.A O no hydrogen 3.560 N/A GLY 171.A N LEU 167.A O no hydrogen 2.744 N/A LYS 172.A N GLU 169.A O no hydrogen 3.290 N/A LEU 175.A N GLY 171.A O no hydrogen 3.056 N/A LYS 176.A N LYS 172.A O no hydrogen 3.124 N/A LYS 176.A N SER 173.A O no hydrogen 3.193 N/A LYS 177.A NZ GLU 174.A OE2 no hydrogen 3.439 N/A VAL 179.A N TYR 206.A O no hydrogen 2.880 N/A LYS 182.A N SER 203.A O no hydrogen 3.073 N/A TRP 184.A N HIS 201.A O no hydrogen 3.009 N/A SER 186.A N VAL 199.A O no hydrogen 2.944 N/A GLY 188.A N LEU 197.A O no hydrogen 2.874 N/A SER 190.A OG ARG 195.A O no hydrogen 2.762 N/A LEU 196.A N VAL 245.A O no hydrogen 2.904 N/A LEU 198.A N LEU 243.A O no hydrogen 2.886 N/A VAL 199.A N SER 186.A O no hydrogen 3.029 N/A CYS 200.A N ALA 241.A O no hydrogen 2.889 N/A HIS 201.A N TRP 184.A O no hydrogen 2.807 N/A HIS 201.A ND1 TRP 184.A O no hydrogen 3.299 N/A VAL 202.A N LEU 239.A O no hydrogen 2.834 N/A SER 203.A N LYS 182.A O no hydrogen 3.262 N/A GLY 204.A N TRP 237.A O no hydrogen 2.791 N/A TYR 206.A N VAL 179.A O no hydrogen 3.191 N/A LYS 208.A N GLU 28.A OE1 no hydrogen 3.211 N/A LYS 208.A N GLU 28.A OE2 no hydrogen 3.244 N/A TRP 211.A N LYS 258.A O no hydrogen 3.153 N/A LYS 213.A N ARG 256.A O no hydrogen 3.110 N/A LYS 213.A NZ GLU 220.A OE1 no hydrogen 3.446 N/A TRP 214.A N THR 224.A OG1 no hydrogen 3.139 N/A TRP 214.A NE1 ALA 241.A O no hydrogen 3.064 N/A MET 215.A N SER 254.A O no hydrogen 2.535 N/A ARG 216.A N GLN 219.A O no hydrogen 3.122 N/A ARG 216.A NH1 GLU 249.A O no hydrogen 3.081 N/A ARG 216.A NH2 GLU 249.A O no hydrogen 2.713 N/A ARG 216.A NH2 ALA 251.A O no hydrogen 2.403 N/A GLN 219.A N ARG 216.A O no hydrogen 3.131 N/A GLN 219.A NE2 GLU 220.A O no hydrogen 3.081 N/A GLN 221.A N TRP 214.A O no hydrogen 2.888 N/A GLN 222.A NE2 GLU 220.A O no hydrogen 3.359 N/A THR 224.A N GLN 221.A O no hydrogen 3.044 N/A THR 224.A OG1 GLN 221.A O no hydrogen 2.729 N/A GLN 225.A N THR 242.A O no hydrogen 2.856 N/A GLY 227.A N ARG 240.A O no hydrogen 3.000 N/A LEU 230.A N TYR 238.A O no hydrogen 2.829 N/A ASN 232.A N THR 236.A O no hydrogen 2.796 N/A ASN 232.A ND2 SER 203.A OG no hydrogen 3.353 N/A ASN 232.A ND2 THR 236.A OG1 no hydrogen 2.972 N/A GLU 235.A N ASN 232.A O no hydrogen 3.329 N/A THR 236.A OG1 ASP 234.A OD1 no hydrogen 2.679 N/A TRP 237.A N PHE 205.A O no hydrogen 2.954 N/A TRP 237.A NE1 GLU 28.A OE1 no hydrogen 3.001 N/A TYR 238.A N LEU 230.A O no hydrogen 2.760 N/A LEU 239.A N VAL 202.A O no hydrogen 2.820 N/A ALA 241.A N CYS 200.A O no hydrogen 2.830 N/A THR 242.A N GLN 225.A O no hydrogen 3.033 N/A THR 242.A OG1 GLN 225.A O no hydrogen 3.498 N/A LEU 243.A N LEU 198.A O no hydrogen 2.923 N/A VAL 245.A N LEU 196.A O no hydrogen 2.990 N/A ALA 247.A N GLY 194.A O no hydrogen 3.176 N/A LEU 253.A N ALA 250.A O no hydrogen 3.181 N/A SER 254.A N MET 215.A O no hydrogen 2.778 N/A SER 254.A OG LEU 269.A O no hydrogen 3.201 N/A CYS 255.A N LEU 269.A O no hydrogen 2.788 N/A ARG 256.A N LYS 213.A O no hydrogen 2.822 N/A VAL 257.A N ILE 267.A O no hydrogen 2.818 N/A LYS 258.A N TRP 211.A O no hydrogen 2.851 N/A LYS 258.A NZ ASP 266.A OD2 no hydrogen 3.160 N/A HIS 259.A ND1 SER 261.A OG no hydrogen 2.900 N/A HIS 259.A NE2 PRO 207.A O no hydrogen 2.767 N/A SER 260.A OG GLN 178.A OE1 no hydrogen 2.893 N/A SER 261.A N HIS 259.A ND1 no hydrogen 3.235 N/A SER 261.A OG VAL 179.A O no hydrogen 3.251 N/A SER 261.A OG HIS 259.A ND1 no hydrogen 2.900 N/A LEU 262.A N HIS 259.A O no hydrogen 2.901 N/A ILE 267.A N VAL 257.A O no hydrogen 2.930 N/A LEU 269.A N CYS 255.A O no hydrogen 2.956 N/A TRP 271.A N LEU 253.A O no hydrogen 2.858 N/A