Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u8t_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 142.A O no hydrogen 3.539 N/A ILE 1.A N ASN 143.A O no hydrogen 2.868 N/A ILE 1.A N ASP 196.A OD2 no hydrogen 2.714 N/A VAL 2.A N ASP 191.A O no hydrogen 2.781 N/A SER 5.A N VAL 154.A O no hydrogen 3.008 N/A ALA 7.A N LEU 152.A O no hydrogen 2.929 N/A MET 11.A N GLU 8.A O no hydrogen 3.105 N/A SER 12.A OG GLN 15.A OE1 no hydrogen 3.054 N/A GLN 15.A N SER 12.A O no hydrogen 2.911 N/A GLN 15.A NE2 THR 139.A O no hydrogen 3.362 N/A VAL 16.A N ALA 30.A O no hydrogen 2.957 N/A MET 17.A N ARG 62.A O no hydrogen 2.883 N/A LEU 18.A N CYS 28.A O no hydrogen 2.850 N/A PHE 19.A N LEU 60.A O no hydrogen 2.922 N/A ARG 20.A N GLU 25.A O no hydrogen 2.774 N/A ARG 20.A NE SER 22.A O no hydrogen 3.309 N/A ARG 20.A NH2 GLU 25.A OE2 no hydrogen 3.456 N/A LYS 21.A N ASP 58.A O no hydrogen 2.959 N/A LYS 21.A NZ ASN 57.A O no hydrogen 3.273 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 2.913 N/A GLU 25.A N ARG 20.A O no hydrogen 3.295 N/A LEU 27.A N LEU 18.A O no hydrogen 2.798 N/A CYS 28.A N LEU 18.A O no hydrogen 3.395 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.012 N/A GLY 29.A N SER 197.A O no hydrogen 2.816 N/A SER 31.A N LEU 39.A O no hydrogen 2.865 N/A SER 31.A OG LEU 39.A O no hydrogen 3.530 N/A SER 31.A OG GLN 213.A OE1 no hydrogen 2.589 N/A LEU 32.A N TRP 14.A O no hydrogen 2.768 N/A ILE 33.A N TRP 37.A O no hydrogen 3.036 N/A ARG 36.A N SER 34.A OG no hydrogen 3.156 N/A ARG 36.A NE ASP 35.A OD2 no hydrogen 2.842 N/A ARG 36.A NH2 ASP 35.A OD1 no hydrogen 2.947 N/A ARG 36.A NH2 ASP 35.A OD2 no hydrogen 3.450 N/A TRP 37.A N SER 34.A OG no hydrogen 3.221 N/A VAL 38.A N MET 103.A O no hydrogen 2.823 N/A LEU 39.A N SER 31.A O no hydrogen 2.919 N/A THR 40.A N ALA 101.A O no hydrogen 2.968 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.858 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.801 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.734 N/A CYS 44.A N ALA 41.A O no hydrogen 3.040 N/A CYS 44.A SG SER 197.A O no hydrogen 3.613 N/A LEU 45.A N ALA 42.A O no hydrogen 2.895 N/A LEU 46.A N ALA 42.A O no hydrogen 2.849 N/A TYR 47.A N LYS 52.A O no hydrogen 2.881 N/A TRP 50.A N TYR 47.A O no hydrogen 2.883 N/A ASP 51.A N PRO 48.A O no hydrogen 2.792 N/A LYS 52.A N TYR 47.A O no hydrogen 3.127 N/A LYS 52.A NZ HIS 43.A O no hydrogen 2.933 N/A PHE 54.A N LEU 45.A O no hydrogen 2.914 N/A THR 55.A N ASP 58.A OD2 no hydrogen 2.928 N/A THR 55.A OG1 GLU 56.A OE1 no hydrogen 3.203 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.757 N/A ASP 58.A N THR 55.A O no hydrogen 3.010 N/A LEU 59.A N GLU 56.A O no hydrogen 3.467 N/A LEU 60.A N PHE 19.A O no hydrogen 2.973 N/A VAL 61.A N SER 79.A O no hydrogen 2.940 N/A ARG 62.A N MET 17.A O no hydrogen 2.854 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.900 N/A ARG 62.A NH1 GLU 76.A OE1 no hydrogen 3.301 N/A ARG 62.A NH1 GLU 76.A OE2 no hydrogen 3.144 N/A ILE 63.A N LYS 77.A O no hydrogen 2.794 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.692 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.716 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.661 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.883 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.346 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.762 N/A ARG 68.A N SER 150.A O no hydrogen 2.939 N/A ARG 68.A NE PRO 149.A O no hydrogen 2.760 N/A THR 69.A N SER 67.A OG no hydrogen 3.197 N/A ARG 70.A N SER 67.A OG no hydrogen 3.024 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.938 N/A ILE 75.A N GLU 72.A O no hydrogen 3.150 N/A GLU 76.A N GLU 72.A O no hydrogen 2.812 N/A LYS 77.A N ILE 63.A O no hydrogen 2.840 N/A LYS 77.A NZ.A GLU 76.A O no hydrogen 2.973 N/A LYS 77.A NZ.B ILE 78.A O no hydrogen 2.949 N/A SER 79.A N VAL 61.A O no hydrogen 2.879 N/A GLU 82.A N LYS 104.A O no hydrogen 2.651 N/A ILE 84.A N GLU 56.A OE2 no hydrogen 2.750 N/A TYR 85.A N LEU 102.A O no hydrogen 2.914 N/A HIS 87.A N ILE 100.A O no hydrogen 3.270 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.885 N/A TYR 90.A N HIS 87.A O no hydrogen 3.055 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.689 N/A ASN 91.A N ASP 97.A O no hydrogen 2.913 N/A ASN 91.A ND2 GLU 94.A OE1 no hydrogen 3.302 N/A GLU 94.A N ASN 91.A OD1 no hydrogen 3.154 N/A ASN 95.A ND2 ARG 172.A O no hydrogen 2.951 N/A LEU 96.A N ASN 91.A O no hydrogen 2.834 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.120 N/A ARG 98.A NH2 ARG 89.A O no hydrogen 2.849 N/A ALA 101.A N THR 40.A O no hydrogen 2.928 N/A LEU 102.A N TYR 85.A O no hydrogen 2.874 N/A MET 103.A N VAL 38.A O no hydrogen 2.780 N/A LYS 104.A N LYS 83.A O no hydrogen 3.021 N/A LYS 104.A NZ GLU 82.A OE1.B no hydrogen 3.038 N/A LEU 105.A N ARG 36.A O no hydrogen 2.889 N/A LYS 106.A N MET 80.A O no hydrogen 2.927 N/A LYS 106.A NZ GLU 82.A OE2.A no hydrogen 2.652 N/A VAL 109.A N ASP 35.A O no hydrogen 2.817 N/A SER 112.A N ILE 115.A O no hydrogen 2.902 N/A TYR 114.A N SER 112.A OG no hydrogen 3.072 N/A ILE 115.A N SER 112.A O no hydrogen 3.393 N/A HIS 116.A N PRO 13.A O no hydrogen 3.005 N/A VAL 118.A N LEU 32.A O no hydrogen 3.060 N/A CYS 119.A N TRP 211.A O no hydrogen 3.121 N/A ARG 123.A NH1 GLU 124.A OE2 no hydrogen 3.295 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.834 N/A THR 125.A N ASP 122.A OD1 no hydrogen 3.096 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.916 N/A ALA 126.A N ASP 122.A O no hydrogen 2.863 N/A ALA 127.A N ARG 123.A O no hydrogen 2.924 N/A SER 128.A N GLU 124.A O no hydrogen 2.918 N/A SER 128.A OG GLU 124.A O no hydrogen 3.144 N/A LEU 129.A N THR 125.A O no hydrogen 2.997 N/A LEU 130.A N ALA 126.A O no hydrogen 3.024 N/A GLN 131.A N LEU 129.A O no hydrogen 2.901 N/A GLN 131.A NE2 ALA 127.A O no hydrogen 2.858 N/A GLY 133.A N ILE 159.A O no hydrogen 2.837 N/A TYR 134.A N GLN 131.A O no hydrogen 3.194 N/A LYS 135.A NZ TYR 182.A OH no hydrogen 3.354 N/A GLY 136.A N LEU 157.A O no hydrogen 2.998 N/A ARG 137.A N VAL 202.A O no hydrogen 2.744 N/A ARG 137.A NE ASN 156.A OD1 no hydrogen 3.062 N/A VAL 138.A N VAL 155.A O no hydrogen 2.965 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.473 N/A GLY 140.A N GLN 153.A O no hydrogen 3.092 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.963 N/A GLY 142.A N ASP 196.A OD1 no hydrogen 2.811 N/A ASN 143.A N GLU 194.A O no hydrogen 2.782 N/A LEU 144.A N GLY 147.A O no hydrogen 2.920 N/A LEU 152.A N HIS 66.A O no hydrogen 2.880 N/A GLN 153.A N GLY 140.A O no hydrogen 2.974 N/A GLN 153.A NE2 ASP 6.A OD1 no hydrogen 2.832 N/A GLN 153.A NE2 VAL 151.A O no hydrogen 3.120 N/A GLN 153.A NE2 LEU 152.A O no hydrogen 3.463 N/A VAL 154.A N SER 5.A O no hydrogen 2.874 N/A VAL 155.A N VAL 138.A O no hydrogen 3.056 N/A LEU 157.A N GLY 136.A O no hydrogen 2.838 N/A ILE 159.A N TYR 134.A O no hydrogen 2.954 N/A VAL 160.A N CYS 179.A O no hydrogen 3.015 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.682 N/A ARG 162.A NH1 MET 177.A O no hydrogen 3.073 N/A ARG 162.A NH2 MET 177.A O no hydrogen 2.828 N/A VAL 164.A N GLU 161.A O no hydrogen 3.035 N/A CYS 165.A N GLU 161.A O no hydrogen 3.075 N/A CYS 165.A SG VAL 160.A O no hydrogen 3.623 N/A CYS 165.A SG GLU 161.A O no hydrogen 3.475 N/A LYS 166.A N ARG 162.A O no hydrogen 2.848 N/A ASP 167.A N PRO 163.A O no hydrogen 2.927 N/A SER 168.A N CYS 165.A O no hydrogen 3.152 N/A SER 168.A OG CYS 165.A O no hydrogen 2.670 N/A THR 169.A N LYS 166.A O no hydrogen 3.530 N/A THR 169.A OG1 GLU 221.A OE1 no hydrogen 2.767 N/A ILE 171.A N THR 169.A OG1 no hydrogen 3.127 N/A ARG 172.A NE GLU 94.A OE2 no hydrogen 2.788 N/A ARG 172.A NH1 GLU 94.A OE1 no hydrogen 2.950 N/A THR 174.A OG1 ASP 97.A OD1 no hydrogen 2.750 N/A ASN 176.A N THR 174.A OG1 no hydrogen 3.027 N/A ASN 176.A ND2 ASP 97.A OD1 no hydrogen 3.057 N/A MET 177.A N THR 174.A O no hydrogen 3.087 N/A PHE 178.A N TYR 232.A O no hydrogen 2.944 N/A ALA 180.A N GLY 230.A O no hydrogen 2.940 N/A GLY 181.A N PRO 158.A O no hydrogen 2.846 N/A LYS 183.A N GLU 186.A OE2 no hydrogen 2.710 N/A LYS 183.A NZ GLU 161.A OE1 no hydrogen 2.908 N/A LYS 183.A NZ GLU 161.A OE2 no hydrogen 3.488 N/A GLU 186.A N LYS 183.A O no hydrogen 3.042 N/A LYS 188.A N GLU 186.A O no hydrogen 2.770 N/A ARG 189.A NE ASP 224.A OD2 no hydrogen 2.807 N/A ARG 189.A NH1 ASP 224.A O no hydrogen 2.810 N/A ARG 189.A NH1 ASP 226.A OD1 no hydrogen 2.760 N/A ARG 189.A NH2 ASP 226.A OD1 no hydrogen 2.821 N/A GLY 190.A N ASP 224.A OD1 no hydrogen 2.844 N/A ASP 191.A N VAL 2.A O no hydrogen 3.252 N/A CYS 193.A N ASP 196.A OD2 no hydrogen 2.791 N/A CYS 193.A SG LYS 145.A O no hydrogen 3.800 N/A ASP 196.A N CYS 193.A O no hydrogen 2.880 N/A GLY 198.A N VAL 217.A O no hydrogen 2.886 N/A GLY 199.A N ASP 196.A O no hydrogen 3.123 N/A PHE 201.A N GLY 215.A O no hydrogen 3.001 N/A VAL 202.A N ARG 137.A O no hydrogen 2.803 N/A MET 203.A N TYR 212.A O no hydrogen 2.899 N/A SER 205.A N ARG 210.A O no hydrogen 2.853 N/A SER 205.A OG ASN 208.A OD1 no hydrogen 3.316 N/A PHE 207.A N SER 205.A OG no hydrogen 3.018 N/A ASN 208.A N SER 205.A OG no hydrogen 3.355 N/A ASN 208.A ND2 TYR 212.A OH no hydrogen 2.946 N/A ASN 209.A N SER 205.A O no hydrogen 2.900 N/A ARG 210.A N ASN 208.A OD1 no hydrogen 3.030 N/A TYR 212.A N MET 203.A O no hydrogen 2.822 N/A GLN 213.A N CYS 119.A O no hydrogen 2.831 N/A GLN 213.A NE2 GLY 215.A O no hydrogen 2.985 N/A MET 214.A N PHE 201.A O no hydrogen 2.929 N/A GLY 215.A N PHE 201.A O no hydrogen 3.013 N/A ILE 216.A N THR 233.A O no hydrogen 3.185 N/A VAL 217.A N GLY 199.A O no hydrogen 2.830 N/A SER 218.A N PHE 231.A O no hydrogen 2.976 N/A SER 218.A OG ASP 99.A OD2 no hydrogen 2.585 N/A TRP 219.A N PHE 231.A O no hydrogen 3.159 N/A CYS 223.A N GLU 146.A OE2 no hydrogen 2.954 N/A CYS 223.A SG ALA 192.A O no hydrogen 3.929 N/A ASP 224.A N ASP 191.A OD2 no hydrogen 2.832 N/A ARG 225.A NE GLU 146.A OE1 no hydrogen 3.497 N/A ARG 225.A NE GLU 146.A OE2 no hydrogen 3.076 N/A ARG 225.A NH1 GLU 146.A OE1 no hydrogen 2.994 N/A LYS 228.A N ARG 225.A O no hydrogen 3.203 N/A LYS 228.A NZ SER 168.A O no hydrogen 2.868 N/A LYS 228.A NZ GLU 221.A OE1 no hydrogen 2.665 N/A GLY 230.A N ALA 180.A O no hydrogen 3.090 N/A PHE 231.A N TRP 219.A O no hydrogen 2.793 N/A TYR 232.A N PHE 178.A O no hydrogen 2.797 N/A THR 233.A N ILE 216.A O no hydrogen 2.878 N/A THR 233.A OG1 ASP 99.A O no hydrogen 2.812 N/A HIS 234.A N ASN 176.A O no hydrogen 2.903 N/A VAL 235.A N MET 214.A O no hydrogen 3.109 N/A ARG 237.A N HIS 234.A ND1 no hydrogen 3.452 N/A LEU 238.A N VAL 235.A O no hydrogen 2.978 N/A LYS 239.A N PHE 236.A O no hydrogen 3.071 N/A LYS 239.A NZ PRO 121.A O no hydrogen 2.951 N/A ILE 242.A N LEU 238.A O no hydrogen 3.259 N/A GLN 243.A N LYS 239.A O no hydrogen 2.909 N/A GLN 243.A NE2 ASP 247.A OD2 no hydrogen 2.835 N/A LYS 244.A N LYS 240.A O no hydrogen 2.907 N/A VAL 245.A N TRP 241.A O no hydrogen 2.980 N/A ILE 246.A N ILE 242.A O no hydrogen 3.058 N/A ASP 247.A N GLN 243.A O no hydrogen 2.790 N/A GLN 248.A N LYS 244.A O no hydrogen 2.984 N/A