Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 74.A O no hydrogen 2.844 N/A ARG 6.A NH1 GLU 77.A O no hydrogen 2.700 N/A ARG 6.A NH1 PRO 79.A O no hydrogen 2.861 N/A ARG 6.A NH2 PRO 79.A O no hydrogen 2.723 N/A ARG 8.A N GLN 5.A O no hydrogen 3.241 N/A ARG 8.A NH2 MET 29.A O no hydrogen 2.967 N/A ILE 9.A N ARG 6.A O no hydrogen 2.763 N/A GLU 10.A N ILE 27.A O no hydrogen 2.884 N/A GLY 12.A N GLN 25.A O no hydrogen 2.817 N/A CYS 14.A SG GLY 16.A O no hydrogen 3.366 N/A CYS 14.A SG VAL 23.A O no hydrogen 3.690 N/A ILE 15.A N VAL 23.A O no hydrogen 2.720 N/A GLY 18.A N GLY 21.A O no hydrogen 2.934 N/A GLN 19.A N GLN 19.A OE1 no hydrogen 2.693 N/A GLN 19.A NE2 GLY 151.A O no hydrogen 2.806 N/A GLN 19.A NE2 ASP 158.A OD1 no hydrogen 2.815 N/A GLY 21.A N GLY 18.A O no hydrogen 3.235 N/A VAL 23.A N GLY 16.A O no hydrogen 2.815 N/A HIS 24.A N ILE 38.A O no hydrogen 2.810 N/A HIS 24.A ND1 GLY 12.A O no hydrogen 2.850 N/A GLN 25.A N ARG 13.A O no hydrogen 2.760 N/A GLY 26.A N VAL 36.A O no hydrogen 2.851 N/A ILE 27.A N GLU 10.A O no hydrogen 3.063 N/A TYR 28.A N LEU 34.A O no hydrogen 2.622 N/A MET 29.A N ARG 8.A O no hydrogen 2.701 N/A SER 30.A N TYR 28.A O no hydrogen 3.222 N/A SER 30.A N ASN 31.A O no hydrogen 3.038 N/A SER 30.A OG ASN 31.A O no hydrogen 2.777 N/A LEU 34.A N TYR 28.A O no hydrogen 3.028 N/A VAL 36.A N GLY 26.A O no hydrogen 2.886 N/A ALA 37.A N MET 84.A O no hydrogen 2.818 N/A ILE 38.A N HIS 24.A O no hydrogen 2.688 N/A LYS 39.A N ILE 82.A O no hydrogen 2.891 N/A LYS 39.A NZ GLU 56.A OE1 no hydrogen 2.697 N/A LYS 39.A NZ ASP 149.A OD2 no hydrogen 2.846 N/A THR 40.A N ASP 22.A O no hydrogen 3.091 N/A THR 40.A OG1 ASP 22.A O no hydrogen 2.676 N/A LYS 42.A N PHE 20.A O no hydrogen 2.887 N/A SER 46.A N ASN 43.A O no hydrogen 3.055 N/A SER 48.A OG SER 46.A OG.B no hydrogen 3.178 N/A ARG 50.A N SER 46.A O no hydrogen 2.948 N/A ARG 50.A NH2 THR 76.A O no hydrogen 2.961 N/A GLU 51.A N ASP 47.A O no hydrogen 2.914 N/A LYS 52.A N SER 48.A O no hydrogen 3.107 N/A PHE 53.A N VAL 49.A O no hydrogen 2.853 N/A LEU 54.A N ARG 50.A O no hydrogen 2.890 N/A GLN 55.A N GLU 51.A O no hydrogen 2.996 N/A GLU 56.A N PHE 53.A O no hydrogen 3.014 N/A LEU 58.A N LEU 54.A O no hydrogen 3.018 N/A THR 59.A N GLN 55.A O no hydrogen 2.866 N/A THR 59.A OG1 GLN 55.A O no hydrogen 3.034 N/A THR 59.A OG1 GLN 55.A OE1 no hydrogen 3.189 N/A MET 60.A N GLU 56.A O no hydrogen 3.287 N/A ARG 61.A N ALA 57.A O no hydrogen 2.909 N/A GLN 62.A NE2 THR 59.A O no hydrogen 3.157 N/A PHE 63.A N MET 60.A O no hydrogen 3.122 N/A ASP 64.A N TYR 121.A OH no hydrogen 2.905 N/A HIS 67.A N HIS 65.A ND1 no hydrogen 2.965 N/A HIS 67.A ND1 VAL 145.A O no hydrogen 2.738 N/A ILE 68.A N HIS 65.A O no hydrogen 3.263 N/A VAL 69.A N LEU 147.A O no hydrogen 3.040 N/A LYS 70.A N GLU 85.A OE1 no hydrogen 2.859 N/A ILE 72.A N ILE 83.A O no hydrogen 2.757 N/A GLY 73.A N ILE 83.A O no hydrogen 3.142 N/A VAL 74.A N TYR 2.A O no hydrogen 2.910 N/A ILE 75.A N TRP 81.A O no hydrogen 2.893 N/A THR 76.A N GLU 3.A OE1 no hydrogen 2.811 N/A THR 76.A OG1 GLU 3.A OE1 no hydrogen 3.140 N/A THR 76.A OG1 GLU 3.A OE2 no hydrogen 2.798 N/A TRP 81.A N ILE 75.A O no hydrogen 3.119 N/A ILE 82.A N LYS 39.A O no hydrogen 3.076 N/A ILE 83.A N GLY 73.A O no hydrogen 2.739 N/A MET 84.A N ALA 37.A O no hydrogen 2.782 N/A GLU 85.A N LYS 70.A O no hydrogen 2.946 N/A LEU 89.A N VAL 139.A O no hydrogen 2.929 N/A GLY 90.A N CYS 87.A O no hydrogen 3.418 N/A LEU 92.A N VAL 137.A O no hydrogen 2.925 N/A ARG 93.A NE GLY 204.A O no hydrogen 2.931 N/A ARG 93.A NH2 GLY 204.A O no hydrogen 2.819 N/A PHE 95.A N GLU 91.A O no hydrogen 3.180 N/A LEU 96.A N LEU 92.A O no hydrogen 2.920 N/A GLN 97.A N ARG 93.A O no hydrogen 3.069 N/A GLN 97.A NE2 GLY 204.A O no hydrogen 3.176 N/A VAL 98.A N SER 94.A O no hydrogen 3.038 N/A ARG 99.A N PHE 95.A O no hydrogen 3.336 N/A LYS 100.A N GLN 97.A O no hydrogen 3.247 N/A LEU 103.A N ARG 99.A O no hydrogen 2.923 N/A SER 107.A N ASP 104.A O no hydrogen 3.054 N/A SER 107.A N ASP 104.A OD2 no hydrogen 3.014 N/A SER 107.A OG ASP 104.A OD1 no hydrogen 2.987 N/A SER 107.A OG ASP 104.A OD2 no hydrogen 3.382 N/A LEU 108.A N ASP 104.A O no hydrogen 3.473 N/A ILE 109.A N LEU 105.A O no hydrogen 3.033 N/A LEU 110.A N ALA 106.A O no hydrogen 2.922 N/A TYR 111.A N SER 107.A O no hydrogen 3.058 N/A TYR 111.A OH ASN 142.A O no hydrogen 2.597 N/A ALA 112.A N LEU 108.A O no hydrogen 3.188 N/A TYR 113.A N ILE 109.A O no hydrogen 2.832 N/A GLN 114.A N LEU 110.A O no hydrogen 2.805 N/A GLN 114.A NE2 ASP 143.A O no hydrogen 2.782 N/A LEU 115.A N TYR 111.A O no hydrogen 2.994 N/A SER 116.A N ALA 112.A O no hydrogen 2.953 N/A SER 116.A OG TYR 113.A O no hydrogen 2.646 N/A THR 117.A N TYR 113.A O no hydrogen 3.098 N/A THR 117.A OG1 GLN 114.A O no hydrogen 2.652 N/A ALA 118.A N GLN 114.A O no hydrogen 3.175 N/A LEU 119.A N LEU 115.A O no hydrogen 2.920 N/A ALA 120.A N SER 116.A O no hydrogen 2.856 N/A TYR 121.A N THR 117.A O no hydrogen 3.094 N/A LEU 122.A N ALA 118.A O no hydrogen 2.999 N/A GLU 123.A N LEU 119.A O no hydrogen 2.891 N/A SER 124.A N ALA 120.A O no hydrogen 2.974 N/A SER 124.A OG TYR 121.A O no hydrogen 2.585 N/A LYS 125.A N LEU 122.A O no hydrogen 3.101 N/A ARG 126.A N GLU 123.A O no hydrogen 2.935 N/A PHE 127.A N LEU 122.A O no hydrogen 2.945 N/A HIS 129.A N ASP 189.A OD2 no hydrogen 2.747 N/A ARG 130.A N ASP 189.A OD1 no hydrogen 2.976 N/A ARG 130.A NE GLU 157.A OE1 no hydrogen 3.374 N/A ARG 130.A NE GLU 157.A OE2 no hydrogen 2.954 N/A ARG 130.A NH1 GLU 157.A OE1 no hydrogen 2.824 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.026 N/A ALA 134.A N GLU 199.A OE2 no hydrogen 2.897 N/A ARG 135.A NE ASP 131.A OD2 no hydrogen 3.059 N/A ARG 135.A NH2 ASP 131.A OD1 no hydrogen 2.774 N/A ARG 135.A NH2 ASP 131.A OD2 no hydrogen 3.167 N/A ASN 136.A N ALA 133.A O no hydrogen 2.952 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.761 N/A ASN 136.A ND2 ASP 131.A OD2 no hydrogen 3.278 N/A ASN 136.A ND2 SER 153.A O no hydrogen 3.324 N/A VAL 137.A N ALA 134.A O no hydrogen 3.095 N/A LEU 138.A N LYS 146.A O no hydrogen 2.768 N/A VAL 139.A N GLY 90.A O no hydrogen 2.739 N/A SER 140.A N CYS 144.A O no hydrogen 2.861 N/A SER 141.A N CYS 144.A O no hydrogen 3.256 N/A SER 141.A OG ASP 143.A OD2 no hydrogen 2.591 N/A CYS 144.A N SER 141.A O no hydrogen 2.993 N/A CYS 144.A SG VAL 145.A O no hydrogen 3.957 N/A VAL 145.A N GLN 114.A OE1 no hydrogen 3.036 N/A LYS 146.A N LEU 138.A O no hydrogen 2.855 N/A LYS 146.A NZ PRO 66.A O no hydrogen 3.422 N/A LYS 146.A NZ GLU 85.A OE2 no hydrogen 2.656 N/A LEU 147.A N HIS 67.A O no hydrogen 2.893 N/A GLY 148.A N ASN 136.A O no hydrogen 2.896 N/A LEU 152.A N ASP 149.A OD2 no hydrogen 2.933 N/A SER 153.A N ASP 149.A O no hydrogen 3.007 N/A SER 153.A OG.A ASP 149.A O no hydrogen 2.752 N/A SER 153.A OG.B PHE 150.A O no hydrogen 2.609 N/A ARG 154.A N GLY 151.A O no hydrogen 3.167 N/A TYR 155.A N LEU 152.A O no hydrogen 3.393 N/A TYR 155.A OH SER 165.A OG no hydrogen 3.407 N/A ASP 158.A N ARG 154.A O no hydrogen 2.915 N/A SER 159.A N MET 156.A O no hydrogen 3.341 N/A SER 159.A OG MET 156.A O no hydrogen 2.686 N/A TYR 161.A N ASP 158.A O no hydrogen 2.920 N/A TYR 162.A N SER 159.A O no hydrogen 3.274 N/A SER 165.A N TYR 162.A O no hydrogen 3.203 N/A SER 165.A OG TYR 155.A OH no hydrogen 3.407 N/A GLY 167.A N SER 165.A OG no hydrogen 2.983 N/A LYS 172.A NZ PHE 208.A O no hydrogen 3.071 N/A LYS 172.A NZ VAL 211.A O no hydrogen 2.697 N/A TRP 173.A N PRO 170.A O no hydrogen 3.059 N/A TRP 173.A NE1 GLU 199.A OE2 no hydrogen 2.788 N/A MET 174.A N ILE 171.A O no hydrogen 3.107 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.871 N/A SER 178.A N ALA 175.A O no hydrogen 2.969 N/A SER 178.A OG ARG 183.A O no hydrogen 2.732 N/A ILE 179.A N ALA 175.A O no hydrogen 3.104 N/A ASN 180.A N PRO 176.A O no hydrogen 2.850 N/A ASN 180.A ND2 GLU 221.A OE1 no hydrogen 2.944 N/A PHE 181.A N GLU 177.A O no hydrogen 2.950 N/A ARG 182.A N SER 178.A O no hydrogen 3.032 N/A ARG 182.A NE SER 178.A O no hydrogen 2.836 N/A ARG 183.A N GLU 177.A O no hydrogen 3.263 N/A THR 185.A N SER 188.A OG no hydrogen 2.813 N/A SER 188.A N THR 185.A OG1 no hydrogen 3.146 N/A SER 188.A OG THR 185.A O no hydrogen 2.924 N/A ASP 189.A N THR 185.A O no hydrogen 3.095 N/A VAL 190.A N SER 186.A O no hydrogen 3.213 N/A TRP 191.A N ALA 187.A O no hydrogen 3.248 N/A MET 192.A N SER 188.A O no hydrogen 3.184 N/A PHE 193.A N ASP 189.A O no hydrogen 2.926 N/A GLY 194.A N VAL 190.A O no hydrogen 3.035 N/A VAL 195.A N TRP 191.A O no hydrogen 3.256 N/A CYS 196.A N MET 192.A O no hydrogen 2.875 N/A MET 197.A N PHE 193.A O no hydrogen 2.863 N/A TRP 198.A N GLY 194.A O no hydrogen 3.053 N/A TRP 198.A NE1 PRO 227.A O no hydrogen 2.725 N/A GLU 199.A N VAL 195.A O no hydrogen 2.903 N/A ILE 200.A N CYS 196.A O no hydrogen 3.055 N/A LEU 201.A N MET 197.A O no hydrogen 3.027 N/A MET 202.A N TRP 198.A O no hydrogen 2.943 N/A HIS 203.A N ILE 200.A O no hydrogen 2.976 N/A GLY 204.A N GLU 199.A O no hydrogen 2.790 N/A VAL 205.A N MET 202.A O no hydrogen 3.402 N/A VAL 211.A N PHE 208.A O no hydrogen 3.163 N/A ASN 213.A ND2 LEU 169.A O no hydrogen 3.151 N/A ASP 215.A N LYS 212.A O no hydrogen 2.838 N/A VAL 216.A N ASN 213.A O no hydrogen 3.149 N/A ARG 219.A N ASP 215.A O no hydrogen 3.471 N/A ARG 219.A NH1 GLU 224.A OE2 no hydrogen 2.942 N/A ILE 220.A N VAL 216.A O no hydrogen 3.019 N/A GLU 221.A N ILE 217.A O no hydrogen 2.810 N/A ASN 222.A N GLY 218.A O no hydrogen 3.043 N/A ASN 222.A N ARG 219.A O no hydrogen 3.070 N/A GLY 223.A N ILE 220.A O no hydrogen 2.947 N/A GLU 224.A N ARG 219.A O no hydrogen 2.961 N/A ARG 225.A NE TRP 244.A O no hydrogen 2.939 N/A ARG 225.A NH1 ILE 220.A O no hydrogen 3.089 N/A ARG 225.A NH1 GLU 224.A O no hydrogen 2.927 N/A ARG 225.A NH2 TRP 244.A O no hydrogen 3.014 N/A CYS 232.A N PRO 229.A O no hydrogen 3.101 N/A CYS 232.A SG PRO 233.A O no hydrogen 3.423 N/A TYR 237.A N PRO 233.A O no hydrogen 3.085 N/A TYR 237.A OH LEU 226.A O no hydrogen 2.549 N/A SER 238.A N PRO 234.A O no hydrogen 2.929 N/A SER 238.A OG PRO 234.A O no hydrogen 3.249 N/A LEU 239.A N THR 235.A O no hydrogen 3.145 N/A MET 240.A N LEU 236.A O no hydrogen 3.059 N/A THR 241.A N TYR 237.A O no hydrogen 2.914 N/A THR 241.A OG1 TYR 237.A O no hydrogen 3.503 N/A THR 241.A OG1 SER 238.A O no hydrogen 2.917 N/A LYS 242.A N SER 238.A O no hydrogen 3.152 N/A LYS 242.A N LEU 239.A O no hydrogen 3.187 N/A CYS 243.A N LEU 239.A O no hydrogen 3.233 N/A CYS 243.A SG LEU 239.A O no hydrogen 3.491 N/A TRP 244.A N MET 240.A O no hydrogen 3.255 N/A TRP 244.A N THR 241.A O no hydrogen 3.278 N/A ALA 245.A N LYS 242.A O no hydrogen 3.296 N/A TYR 246.A OH GLU 221.A OE1 no hydrogen 2.666 N/A SER 249.A N ASP 247.A OD2 no hydrogen 3.041 N/A SER 249.A OG ASP 247.A OD1 no hydrogen 3.179 N/A SER 249.A OG ASP 247.A OD2 no hydrogen 2.747 N/A ARG 250.A N ASP 247.A O no hydrogen 3.006 N/A ARG 251.A N PRO 248.A O no hydrogen 3.109 N/A ARG 251.A NE ALA 245.A O no hydrogen 2.834 N/A ARG 251.A NH1 GLU 177.A OE1 no hydrogen 2.855 N/A ARG 251.A NH1 GLU 177.A OE2 no hydrogen 3.537 N/A ARG 251.A NH1 ALA 245.A O no hydrogen 3.248 N/A ARG 251.A NH1 TYR 246.A O no hydrogen 3.209 N/A ARG 251.A NH2 GLU 177.A OE2 no hydrogen 2.744 N/A ARG 251.A NH2 ALA 187.A O no hydrogen 2.935 N/A ARG 253.A NH1 GLU 123.A OE2 no hydrogen 3.416 N/A ARG 253.A NH1 SER 186.A OG no hydrogen 3.053 N/A PHE 254.A N GLU 123.A OE2 no hydrogen 3.219 N/A LEU 257.A N ARG 253.A O no hydrogen 3.158 N/A LYS 258.A N PHE 254.A O no hydrogen 2.868 N/A ALA 259.A N THR 255.A O no hydrogen 3.116 N/A GLN 260.A N GLU 256.A O no hydrogen 2.927 N/A LEU 261.A N LEU 257.A O no hydrogen 2.803 N/A SER 262.A N LYS 258.A O no hydrogen 2.963 N/A THR 263.A N ALA 259.A O no hydrogen 3.264 N/A THR 263.A OG1 ALA 259.A O no hydrogen 3.185 N/A ILE 264.A N GLN 260.A O no hydrogen 3.063 N/A LEU 265.A N LEU 261.A O no hydrogen 2.896 N/A GLU 266.A N SER 262.A O no hydrogen 2.977 N/A GLU 267.A N THR 263.A O no hydrogen 3.061 N/A GLU 268.A N ILE 264.A O no hydrogen 3.042 N/A LYS 269.A N LEU 265.A O no hydrogen 2.955 N/A ALA 270.A N GLU 266.A O no hydrogen 3.092 N/A GLN 271.A N GLU 268.A O no hydrogen 3.125 N/A