Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uie_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ASP 7.A OD2 no hydrogen 2.822 N/A LYS 5.A NZ ASP 114.A OD2 no hydrogen 3.291 N/A ASP 7.A N GLU 4.A O no hydrogen 2.987 N/A ARG 8.A N GLU 4.A O no hydrogen 3.158 N/A ARG 8.A NE ASP 86.A O no hydrogen 2.908 N/A ARG 8.A NH1 VAL 3.A O no hydrogen 3.330 N/A ARG 8.A NH2 ASP 86.A O no hydrogen 3.013 N/A GLN 9.A N LYS 5.A O no hydrogen 2.886 N/A ARG 10.A N VAL 6.A O no hydrogen 2.955 N/A ARG 10.A NH2 ASP 7.A OD1 no hydrogen 3.083 N/A LEU 11.A N ASP 7.A O no hydrogen 3.035 N/A LEU 12.A N ARG 8.A O no hydrogen 3.034 N/A GLN 14.A N GLN 9.A O no hydrogen 3.360 N/A GLN 14.A NE2 LEU 46.A O no hydrogen 2.855 N/A GLN 14.A NE2 GLY 88.A O no hydrogen 2.931 N/A LYS 15.A N TYR 188.A O no hydrogen 2.905 N/A LYS 15.A NZ GLY 187.A O no hydrogen 2.801 N/A LYS 15.A NZ GLN 190.A O no hydrogen 2.815 N/A LYS 15.A NZ ALA 191.A O no hydrogen 3.122 N/A GLY 16.A N GLN 9.A OE1 no hydrogen 2.903 N/A CYS 17.A N ILE 89.A O no hydrogen 3.122 N/A CYS 17.A SG LYS 15.A O no hydrogen 3.727 N/A VAL 18.A N ASP 114.A O no hydrogen 2.829 N/A ILE 19.A N CYS 91.A O no hydrogen 2.688 N/A TRP 20.A N VAL 116.A O no hydrogen 2.808 N/A TRP 20.A NE1 SER 97.A OG no hydrogen 3.030 N/A VAL 21.A N ALA 93.A O no hydrogen 2.681 N/A THR 22.A N VAL 118.A O no hydrogen 2.959 N/A THR 22.A OG1 ILE 96.A O no hydrogen 2.819 N/A THR 22.A OG1 SER 97.A O no hydrogen 3.339 N/A THR 22.A OG1 SER 97.A OG no hydrogen 3.198 N/A THR 22.A OG1 TYR 154.A OH no hydrogen 2.774 N/A SER 27.A N LEU 24.A O no hydrogen 3.115 N/A SER 27.A OG LEU 24.A O no hydrogen 2.608 N/A LYS 29.A NZ GLY 23.A O no hydrogen 3.077 N/A LYS 29.A NZ LEU 24.A O no hydrogen 2.940 N/A SER 30.A OG ASP 51.A OD1 no hydrogen 2.597 N/A LEU 32.A N GLY 28.A O no hydrogen 3.026 N/A ALA 33.A N LYS 29.A O no hydrogen 2.844 N/A CYS 34.A N.A SER 30.A O no hydrogen 2.944 N/A CYS 34.A N.B SER 30.A O no hydrogen 2.963 N/A CYS 34.A SG.A SER 30.A O no hydrogen 3.414 N/A ALA 35.A N THR 31.A O no hydrogen 3.068 N/A LEU 36.A N LEU 32.A O no hydrogen 2.891 N/A ASN 37.A N ALA 33.A O no hydrogen 2.971 N/A GLN 38.A N CYS 34.A O.A no hydrogen 2.851 N/A GLN 38.A N CYS 34.A O.B no hydrogen 3.024 N/A MET 39.A N ALA 35.A O no hydrogen 3.041 N/A LEU 40.A N LEU 36.A O no hydrogen 2.873 N/A TYR 41.A N ASN 37.A O no hydrogen 2.861 N/A GLN 42.A N GLN 38.A O no hydrogen 3.108 N/A LYS 43.A N MET 39.A O no hydrogen 3.277 N/A GLY 44.A N TYR 41.A O no hydrogen 2.848 N/A LYS 45.A N LEU 40.A O no hydrogen 2.893 N/A LYS 45.A NZ ASP 13.A O no hydrogen 2.943 N/A LYS 45.A NZ LEU 189.A O no hydrogen 2.937 N/A LEU 46.A N GLN 14.A OE1 no hydrogen 2.850 N/A CYS 47.A SG.B ASN 37.A O no hydrogen 3.734 N/A CYS 47.A SG.B ASN 37.A OD1 no hydrogen 2.631 N/A TYR 48.A N ILE 90.A O no hydrogen 3.069 N/A LEU 50.A N ILE 92.A O no hydrogen 2.774 N/A GLY 52.A N SER 94.A O no hydrogen 2.880 N/A ASP 53.A N ASP 51.A OD2 no hydrogen 3.134 N/A VAL 55.A N ASP 51.A O no hydrogen 2.877 N/A ARG 56.A N GLY 52.A O no hydrogen 3.014 N/A ARG 56.A NH1 SER 64.A O no hydrogen 2.987 N/A ARG 56.A NH2 SER 64.A O no hydrogen 3.121 N/A HIS 57.A N ASN 54.A O no hydrogen 2.872 N/A HIS 57.A ND1 ASP 53.A O no hydrogen 2.849 N/A GLY 58.A N VAL 55.A O no hydrogen 3.135 N/A ASN 60.A N VAL 55.A O no hydrogen 2.861 N/A ASN 60.A ND2 ASN 73.A O no hydrogen 3.627 N/A ASN 60.A ND2 ASN 73.A OD1 no hydrogen 2.794 N/A ARG 61.A N GLY 58.A O no hydrogen 3.110 N/A ARG 61.A NE GLY 58.A O no hydrogen 3.149 N/A LEU 63.A N ASN 60.A O no hydrogen 3.095 N/A SER 64.A N ASP 69.A OD2 no hydrogen 2.701 N/A SER 64.A OG ASP 69.A OD2 no hydrogen 2.803 N/A LYS 66.A N SER 64.A OG no hydrogen 3.121 N/A ASP 69.A N LYS 66.A O no hydrogen 2.934 N/A ARG 70.A N LYS 66.A O no hydrogen 2.967 N/A ARG 70.A NE PHE 65.A O no hydrogen 3.209 N/A ARG 70.A NH2 GLY 146.A O no hydrogen 3.133 N/A ALA 71.A N ALA 67.A O no hydrogen 3.069 N/A GLU 72.A N GLU 68.A O no hydrogen 3.110 N/A ASN 73.A N ASP 69.A O no hydrogen 2.844 N/A ILE 74.A N ARG 70.A O no hydrogen 2.943 N/A ARG 75.A N ALA 71.A O no hydrogen 2.810 N/A ARG 75.A NE GLU 72.A OE1 no hydrogen 2.841 N/A ARG 75.A NH2 GLU 72.A OE2 no hydrogen 2.856 N/A ARG 76.A N GLU 72.A O no hydrogen 2.888 N/A ARG 76.A NE GLU 72.A OE2 no hydrogen 2.872 N/A ARG 76.A NH1 ASN 60.A OD1 no hydrogen 3.114 N/A ARG 76.A NH1 ASP 62.A OD1 no hydrogen 2.895 N/A ARG 76.A NH1 ASP 62.A OD2 no hydrogen 3.443 N/A ARG 76.A NH2 ASP 62.A OD2 no hydrogen 3.053 N/A VAL 77.A N ASN 73.A O no hydrogen 3.039 N/A GLY 78.A N ILE 74.A O no hydrogen 2.849 N/A GLU 79.A N ARG 75.A O no hydrogen 3.057 N/A VAL 80.A N ARG 76.A O no hydrogen 2.915 N/A ALA 81.A N VAL 77.A O no hydrogen 2.810 N/A LYS 82.A N GLY 78.A O no hydrogen 3.009 N/A LYS 82.A NZ LEU 109.A O no hydrogen 3.093 N/A LEU 83.A N GLU 79.A O no hydrogen 3.156 N/A PHE 84.A N VAL 80.A O no hydrogen 2.974 N/A ALA 85.A N ALA 81.A O no hydrogen 2.901 N/A ASP 86.A N LYS 82.A O no hydrogen 2.916 N/A ALA 87.A N LEU 83.A O no hydrogen 2.961 N/A GLY 88.A N ALA 85.A O no hydrogen 2.964 N/A ILE 89.A N PHE 84.A O no hydrogen 2.983 N/A ILE 90.A N LEU 46.A O no hydrogen 3.189 N/A CYS 91.A N CYS 17.A O no hydrogen 2.889 N/A CYS 91.A SG TYR 48.A O no hydrogen 3.913 N/A ILE 92.A N TYR 48.A O no hydrogen 2.939 N/A ALA 93.A N ILE 19.A O no hydrogen 2.800 N/A SER 94.A N LEU 50.A O no hydrogen 2.913 N/A SER 94.A OG.A ASP 51.A OD1 no hydrogen 3.214 N/A SER 94.A OG.B ASP 51.A OD1 no hydrogen 2.799 N/A LEU 95.A N VAL 21.A O no hydrogen 3.263 N/A SER 97.A OG THR 22.A OG1 no hydrogen 3.198 N/A SER 97.A OG LEU 95.A O no hydrogen 2.887 N/A TYR 99.A OH ASP 152.A OD2 no hydrogen 2.631 N/A ARG 100.A N GLU 155.A OE1 no hydrogen 2.864 N/A ARG 100.A NE PRO 156.A O no hydrogen 2.999 N/A ARG 100.A NH2 PRO 156.A O no hydrogen 2.793 N/A ASP 102.A N TYR 99.A O no hydrogen 3.165 N/A ARG 103.A N TYR 99.A O no hydrogen 3.067 N/A ARG 103.A NE GLU 117.A OE2 no hydrogen 2.835 N/A ARG 103.A NH1 SER 97.A O no hydrogen 2.809 N/A ARG 103.A NH1 GLU 155.A O no hydrogen 2.970 N/A ARG 103.A NH2 GLU 155.A O no hydrogen 2.795 N/A ASP 104.A N ARG 100.A O no hydrogen 2.838 N/A ALA 105.A N THR 101.A O no hydrogen 3.115 N/A CYS 106.A N ASP 102.A O no hydrogen 3.255 N/A CYS 106.A SG ILE 74.A O no hydrogen 3.427 N/A CYS 106.A SG ASP 102.A O no hydrogen 3.481 N/A ARG 107.A N ARG 103.A O no hydrogen 3.091 N/A ARG 107.A NH1 GLU 161.A OE2 no hydrogen 2.835 N/A ARG 107.A NH2 GLU 117.A OE1 no hydrogen 2.938 N/A ARG 107.A NH2 GLU 161.A OE1 no hydrogen 2.883 N/A ARG 107.A NH2 GLU 161.A OE2 no hydrogen 3.386 N/A SER 108.A N ASP 104.A O no hydrogen 3.018 N/A SER 108.A OG.A ASP 104.A O no hydrogen 3.171 N/A SER 108.A OG.B ALA 105.A O no hydrogen 2.780 N/A LEU 109.A N CYS 106.A O no hydrogen 3.179 N/A LEU 110.A N ARG 107.A O no hydrogen 3.104 N/A ASP 114.A N PRO 111.A O no hydrogen 3.071 N/A VAL 116.A N VAL 18.A O no hydrogen 2.830 N/A GLU 117.A N GLU 161.A OE1 no hydrogen 2.808 N/A VAL 118.A N TRP 20.A O no hydrogen 2.705 N/A PHE 119.A N ILE 162.A O no hydrogen 2.889 N/A MET 120.A N THR 22.A O no hydrogen 2.964 N/A ASP 121.A N LEU 164.A O no hydrogen 2.694 N/A VAL 122.A N MET 120.A O no hydrogen 2.851 N/A CYS 127.A N PRO 123.A O no hydrogen 3.160 N/A CYS 127.A SG VAL 122.A O no hydrogen 3.667 N/A CYS 127.A SG PRO 123.A O no hydrogen 3.629 N/A GLU 128.A N LEU 124.A O no hydrogen 2.806 N/A ALA 129.A N SER 125.A O no hydrogen 3.038 N/A ARG 130.A N VAL 126.A O no hydrogen 3.015 N/A ARG 130.A NH1 GLY 26.A O no hydrogen 3.036 N/A ASP 131.A N CYS 127.A O no hydrogen 2.719 N/A GLY 134.A N ASP 131.A O no hydrogen 3.196 N/A TYR 136.A N ASP 131.A OD1 no hydrogen 2.958 N/A TYR 136.A OH SER 25.A O no hydrogen 2.558 N/A LYS 137.A N ASP 131.A OD2 no hydrogen 3.429 N/A LEU 138.A N GLY 134.A O no hydrogen 3.285 N/A ALA 139.A N LEU 135.A O no hydrogen 2.832 N/A ARG 140.A N TYR 136.A O no hydrogen 2.746 N/A ARG 140.A NE GLU 128.A OE2 no hydrogen 2.901 N/A ARG 140.A NH2 GLU 128.A OE1 no hydrogen 3.153 N/A ALA 141.A N LYS 137.A O no hydrogen 2.963 N/A GLY 142.A N ALA 139.A O no hydrogen 3.024 N/A LYS 143.A N LEU 138.A O no hydrogen 2.894 N/A ILE 144.A N LEU 138.A O no hydrogen 3.341 N/A GLY 149.A N ASP 152.A O no hydrogen 2.833 N/A ILE 150.A N PHE 147.A O no hydrogen 2.983 N/A ASP 151.A N PHE 147.A O no hydrogen 2.899 N/A TYR 154.A OH THR 22.A OG1 no hydrogen 2.774 N/A GLU 155.A N PRO 98.A O no hydrogen 2.787 N/A CYS 160.A SG ILE 162.A O no hydrogen 3.363 N/A CYS 160.A SG SER 163.A OG.B no hydrogen 3.098 N/A ILE 162.A N GLU 117.A O no hydrogen 3.191 N/A LEU 164.A N PHE 119.A O no hydrogen 2.773 N/A ARG 166.A NE ASP 121.A OD2 no hydrogen 3.319 N/A ARG 166.A NH2 ASP 121.A OD1 no hydrogen 3.196 N/A GLU 174.A N SER 171.A OG no hydrogen 2.976 N/A MET 175.A N SER 171.A O no hydrogen 2.849 N/A ALA 176.A N PRO 172.A O no hydrogen 2.856 N/A GLU 177.A N ILE 173.A O no hydrogen 2.910 N/A LYS 178.A N GLU 174.A O no hydrogen 3.120 N/A VAL 179.A N MET 175.A O no hydrogen 3.161 N/A VAL 180.A N ALA 176.A O no hydrogen 2.788 N/A GLY 181.A N GLU 177.A O no hydrogen 2.850 N/A TYR 182.A N LYS 178.A O no hydrogen 3.079 N/A LEU 183.A N VAL 179.A O no hydrogen 2.933 N/A ASP 184.A N VAL 180.A O no hydrogen 2.750 N/A ASN 185.A N GLY 181.A O no hydrogen 2.976 N/A LYS 186.A N TYR 182.A O no hydrogen 2.948 N/A GLY 187.A N ASP 184.A O no hydrogen 3.043 N/A TYR 188.A N LEU 183.A O no hydrogen 3.018 N/A TYR 188.A OH GLY 113.A O no hydrogen 2.308 N/A TYR 188.A OH ASP 114.A OD1 no hydrogen 3.255 N/A ALA 191.A N ASP 13.A OD1 no hydrogen 2.861 N/A