Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ngg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 2.A OG1 no hydrogen 2.970 N/A PHE 6.A N THR 2.A O no hydrogen 3.062 N/A LEU 7.A N ILE 3.A O no hydrogen 2.927 N/A ALA 8.A N LYS 4.A O no hydrogen 2.936 N/A VAL 9.A N ASP 5.A O no hydrogen 2.983 N/A ALA 10.A N PHE 6.A O no hydrogen 2.805 N/A MET 11.A N LEU 7.A O no hydrogen 2.818 N/A LYS 12.A N VAL 9.A O no hydrogen 3.085 N/A TRP 14.A N VAL 9.A O no hydrogen 3.441 N/A THR 15.A N LYS 12.A O no hydrogen 3.125 N/A THR 15.A OG1 LYS 12.A O no hydrogen 3.037 N/A ALA 16.A N LYS 13.A O no hydrogen 3.210 N/A PHE 21.A N TYR 29.A O no hydrogen 3.102 N/A GLN 22.A NE2 ASP 25.A O no hydrogen 2.761 N/A LEU 23.A N ILE 27.A O no hydrogen 2.861 N/A ILE 24.A N ILE 27.A O no hydrogen 3.311 N/A ASN 26.A ND2 LYS 41.A O no hydrogen 2.882 N/A ILE 27.A N ILE 24.A O no hydrogen 2.901 N/A TYR 28.A N VAL 39.A O.A no hydrogen 2.838 N/A TYR 28.A N VAL 39.A O.B no hydrogen 2.929 N/A TYR 29.A N PHE 21.A O no hydrogen 2.780 N/A TYR 29.A OH THR 32.A O no hydrogen 2.719 N/A VAL 30.A N VAL 37.A O no hydrogen 2.872 N/A THR 32.A N ILE 35.A O no hydrogen 2.839 N/A THR 32.A OG1 TRP 14.A O no hydrogen 2.758 N/A THR 32.A OG1 ILE 35.A O no hydrogen 3.444 N/A ASP 33.A N ALA 16.A O no hydrogen 2.874 N/A GLY 34.A N THR 32.A OG1 no hydrogen 3.200 N/A ILE 35.A N THR 32.A OG1 no hydrogen 2.930 N/A ALA 36.A N PRO 221.A O no hydrogen 2.901 N/A TYR 38.A N MET 49.A O no hydrogen 3.145 N/A TYR 38.A OH GLY 220.A O no hydrogen 2.685 N/A TYR 38.A OH TYR 226.A OH no hydrogen 2.723 N/A VAL 39.A N.A TYR 28.A O no hydrogen 2.909 N/A VAL 39.A N.B TYR 28.A O no hydrogen 2.965 N/A ILE 40.A N ILE 47.A O no hydrogen 2.837 N/A LYS 41.A N ASN 26.A O no hydrogen 2.904 N/A THR 42.A N GLY 45.A O no hydrogen 2.942 N/A THR 42.A OG1 GLY 45.A O no hydrogen 2.707 N/A THR 42.A OG1 LEU 144.A O no hydrogen 3.479 N/A SER 43.A N ASP 146.A OD1 no hydrogen 3.042 N/A GLN 44.A N THR 42.A OG1 no hydrogen 2.946 N/A GLY 45.A N THR 42.A O no hydrogen 3.400 N/A LEU 46.A N ASP 73.A O no hydrogen 2.897 N/A ILE 47.A N ILE 40.A O no hydrogen 2.954 N/A LEU 48.A N LEU 76.A O.A no hydrogen 2.894 N/A LEU 48.A N LEU 76.A O.B no hydrogen 2.865 N/A MET 49.A N TYR 38.A O no hydrogen 2.840 N/A ASP 50.A N LEU 78.A O no hydrogen 2.914 N/A THR 51.A N HIS 86.A O no hydrogen 2.808 N/A THR 51.A OG1 HIS 86.A O no hydrogen 3.024 N/A GLN 55.A N GLN 55.A OE1.A no hydrogen 2.793 N/A SER 56.A N MET 53.A O no hydrogen 2.915 N/A THR 57.A OG1 PRO 54.A O no hydrogen 3.447 N/A ILE 60.A N SER 56.A O no hydrogen 3.117 N/A LYS 61.A N THR 57.A O no hydrogen 2.960 N/A LYS 61.A NZ GLU 92.A OE2 no hydrogen 2.762 N/A LYS 61.A NZ GLU 96.A OE1 no hydrogen 2.746 N/A ASP 62.A N GLY 58.A O no hydrogen 2.901 N/A ASN 63.A N MET 59.A O no hydrogen 2.896 N/A ASN 63.A ND2 VAL 30.A O no hydrogen 2.937 N/A ILE 64.A N ILE 60.A O no hydrogen 3.039 N/A ALA 65.A N LYS 61.A O no hydrogen 3.113 N/A LYS 66.A N ASP 62.A O no hydrogen 2.868 N/A LEU 67.A N ASN 63.A O no hydrogen 3.347 N/A LEU 67.A N ILE 64.A O no hydrogen 3.266 N/A GLY 68.A N ALA 65.A O no hydrogen 2.862 N/A PHE 69.A N ILE 64.A O no hydrogen 3.246 N/A ASP 73.A N LYS 70.A O no hydrogen 2.920 N/A ILE 74.A N VAL 71.A O no hydrogen 3.030 N/A LYS 75.A N LEU 46.A O no hydrogen 2.919 N/A ILE 77.A N GLN 100.A O no hydrogen 2.842 N/A LEU 78.A N LEU 48.A O no hydrogen 2.857 N/A ASN 79.A N VAL 102.A O no hydrogen 3.146 N/A ASN 79.A ND2 ASP 50.A OD1 no hydrogen 2.802 N/A ASN 79.A ND2 HIS 81.A O no hydrogen 2.939 N/A THR 80.A N ASP 50.A OD1 no hydrogen 2.918 N/A THR 80.A OG1 ASP 50.A OD1 no hydrogen 3.360 N/A THR 80.A OG1 ASP 50.A OD2 no hydrogen 2.715 N/A HIS 81.A ND1 CYS 181.A O no hydrogen 2.727 N/A ALA 82.A N ASP 107.A OD2 no hydrogen 2.974 N/A HIS 83.A N HIS 81.A O no hydrogen 3.159 N/A HIS 86.A N HIS 83.A O no hydrogen 2.856 N/A THR 87.A N HIS 83.A O no hydrogen 3.078 N/A THR 87.A OG1 HIS 83.A O no hydrogen 3.132 N/A GLY 89.A N THR 51.A OG1 no hydrogen 2.905 N/A PHE 90.A N THR 87.A O no hydrogen 3.068 N/A ILE 93.A N GLY 89.A O no hydrogen 2.929 N/A LYS 94.A N PHE 90.A O no hydrogen 2.847 N/A LYS 94.A NZ.A LYS 131.A O no hydrogen 2.682 N/A LYS 94.A NZ.A ASP 133.A OD1 no hydrogen 3.559 N/A LYS 94.A NZ.A ASP 133.A OD2 no hydrogen 2.733 N/A LYS 94.A NZ.B LYS 131.A O no hydrogen 2.867 N/A LYS 94.A NZ.B ASP 133.A OD2 no hydrogen 2.953 N/A LYS 95.A N ALA 91.A O no hydrogen 3.051 N/A GLU 96.A N GLU 92.A O no hydrogen 2.994 N/A THR 97.A N ILE 93.A O no hydrogen 2.994 N/A THR 97.A OG1 ILE 93.A O no hydrogen 2.750 N/A GLY 98.A N LYS 94.A O no hydrogen 2.871 N/A ALA 99.A N THR 97.A OG1 no hydrogen 3.072 N/A GLN 100.A N LYS 75.A O no hydrogen 3.126 N/A LEU 101.A N ASP 133.A OD2 no hydrogen 2.882 N/A VAL 102.A N ILE 77.A O no hydrogen 2.827 N/A ALA 103.A N ARG 134.A O no hydrogen 3.128 N/A GLU 105.A N VAL 136.A O no hydrogen 2.971 N/A ARG 106.A NE PRO 159.A O no hydrogen 3.020 N/A ARG 106.A NH1 PRO 159.A O no hydrogen 2.918 N/A ARG 106.A NH1 ASP 202.A OD2 no hydrogen 2.723 N/A ASP 107.A N GLY 104.A O no hydrogen 2.936 N/A LYS 108.A N GLU 105.A O no hydrogen 3.110 N/A LEU 111.A N ASP 107.A O no hydrogen 3.007 N/A GLU 112.A N LYS 108.A O no hydrogen 2.894 N/A GLY 113.A N PRO 109.A O no hydrogen 2.964 N/A GLY 114.A N LEU 110.A O no hydrogen 2.806 N/A TYR 116.A OH ASN 188.A OD1 no hydrogen 2.710 N/A GLY 118.A N GLU 120.A OE2 no hydrogen 2.924 N/A ASP 119.A N TYR 116.A O no hydrogen 3.031 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.828 N/A ASN 122.A N ASP 119.A O no hydrogen 3.110 N/A ASN 122.A ND2 ASP 119.A OD2 no hydrogen 2.963 N/A ASP 124.A N.A ASN 122.A OD1 no hydrogen 3.062 N/A ASP 124.A N.B ASN 122.A OD1 no hydrogen 3.014 N/A LEU 125.A N ASN 122.A O no hydrogen 3.137 N/A ALA 126.A N GLU 123.A O no hydrogen 3.245 N/A PHE 127.A N GLY 114.A O no hydrogen 3.098 N/A VAL 130.A N LEU 111.A O no hydrogen 2.993 N/A VAL 132.A N GLU 112.A OE2 no hydrogen 2.900 N/A ASP 133.A N LEU 101.A O no hydrogen 2.859 N/A ARG 134.A N LEU 101.A O no hydrogen 3.204 N/A ARG 134.A NH1 ARG 141.A O no hydrogen 3.021 N/A ARG 134.A NH2 ARG 141.A O no hydrogen 2.881 N/A VAL 136.A N ALA 103.A O no hydrogen 2.879 N/A LYS 137.A N ASP 140.A OD2 no hydrogen 2.859 N/A GLY 139.A N ALA 151.A O no hydrogen 2.787 N/A ASP 140.A N LYS 137.A O no hydrogen 3.082 N/A VAL 142.A N LEU 149.A O no hydrogen 2.826 N/A THR 143.A OG1 THR 148.A OG1 no hydrogen 2.774 N/A LEU 144.A N THR 147.A O no hydrogen 2.953 N/A ASP 146.A N SER 43.A OG no hydrogen 2.959 N/A THR 147.A N LEU 144.A O no hydrogen 3.048 N/A THR 147.A OG1 ASP 146.A OD1 no hydrogen 2.899 N/A THR 148.A OG1 THR 143.A OG1 no hydrogen 2.774 N/A LEU 149.A N VAL 142.A O no hydrogen 2.845 N/A THR 150.A N GLU 165.A O no hydrogen 2.849 N/A ALA 151.A N ASP 140.A O no hydrogen 2.849 N/A HIS 152.A N SER 163.A O no hydrogen 2.797 N/A HIS 152.A NE2 GLU 165.A OE1 no hydrogen 2.712 N/A ALA 153.A N GLU 138.A OE1 no hydrogen 2.828 N/A THR 154.A N CYS 161.A O no hydrogen 2.979 N/A THR 154.A OG1 CYS 161.A O no hydrogen 3.435 N/A THR 154.A OG1 SER 163.A OG no hydrogen 2.763 N/A GLY 156.A N SER 158.A O.A no hydrogen 3.058 N/A GLY 156.A N SER 158.A O.B no hydrogen 3.053 N/A HIS 157.A ND1 THR 184.A O no hydrogen 2.822 N/A SER 158.A OG.A ASP 107.A OD1 no hydrogen 3.158 N/A SER 158.A OG.A ASP 107.A OD2 no hydrogen 2.799 N/A SER 158.A OG.B ASP 107.A OD1 no hydrogen 2.767 N/A SER 158.A OG.B ASP 107.A OD2 no hydrogen 3.137 N/A GLY 160.A N ASP 107.A OD1 no hydrogen 2.782 N/A CYS 161.A N SER 158.A O.A no hydrogen 3.408 N/A CYS 161.A N SER 158.A O.B no hydrogen 3.412 N/A CYS 161.A SG SER 182.A O no hydrogen 3.546 N/A THR 162.A N THR 80.A O no hydrogen 2.827 N/A THR 162.A OG1 GLY 160.A O no hydrogen 2.827 N/A SER 163.A N HIS 152.A O no hydrogen 2.943 N/A SER 163.A OG THR 154.A OG1 no hydrogen 2.763 N/A TRP 164.A N PHE 179.A O no hydrogen 3.005 N/A TRP 164.A NE1 ASN 79.A O no hydrogen 2.952 N/A GLU 165.A N THR 150.A O no hydrogen 2.856 N/A MET 166.A N VAL 177.A O no hydrogen 2.977 N/A THR 167.A OG1 GLU 176.A OE1 no hydrogen 2.624 N/A VAL 168.A N ARG 175.A O no hydrogen 2.885 N/A LYS 169.A N ASP 25.A OD2 no hydrogen 2.843 N/A LYS 169.A NZ LYS 172.A O no hydrogen 2.901 N/A LYS 169.A NZ ASP 174.A OD1 no hydrogen 2.831 N/A ASP 170.A N GLU 173.A O no hydrogen 2.841 N/A GLU 173.A N ASP 170.A O no hydrogen 3.067 N/A ARG 175.A N VAL 168.A O no hydrogen 2.838 N/A ARG 175.A NH1 ASP 216.A OD1 no hydrogen 2.894 N/A GLU 176.A N ASP 216.A OD2 no hydrogen 2.785 N/A VAL 177.A N MET 166.A O no hydrogen 2.774 N/A LEU 178.A N VAL 217.A O no hydrogen 2.965 N/A PHE 179.A N TRP 164.A O no hydrogen 2.811 N/A PHE 180.A N LEU 219.A O no hydrogen 2.941 N/A CYS 181.A N SER 163.A OG no hydrogen 3.005 N/A CYS 181.A SG THR 154.A O no hydrogen 3.358 N/A CYS 181.A SG THR 154.A OG1 no hydrogen 3.088 N/A CYS 181.A SG SER 182.A O no hydrogen 3.469 N/A THR 184.A N SER 182.A OG no hydrogen 3.287 N/A THR 184.A OG1 HIS 157.A ND1 no hydrogen 3.131 N/A THR 184.A OG1 SER 182.A OG no hydrogen 3.325 N/A ASN 188.A N VAL 185.A O no hydrogen 2.934 N/A ASN 188.A ND2 HIS 157.A O no hydrogen 2.903 N/A ASN 188.A ND2 TYR 203.A OH no hydrogen 2.937 N/A ARG 189.A N THR 195.A OG1 no hydrogen 2.808 N/A ARG 189.A NE GLN 193.A O no hydrogen 2.817 N/A ARG 189.A NH1 GLY 118.A O no hydrogen 3.157 N/A ARG 189.A NH2 GLY 118.A O no hydrogen 3.064 N/A ARG 189.A NH2 GLN 193.A O no hydrogen 3.175 N/A LEU 190.A N GLN 267.A OE1 no hydrogen 2.758 N/A THR 195.A N ARG 189.A O no hydrogen 2.899 N/A THR 195.A OG1 ARG 189.A O no hydrogen 3.562 N/A TYR 196.A OH ASP 202.A OD2 no hydrogen 2.653 N/A ILE 199.A N TYR 196.A O no hydrogen 3.362 N/A ASP 202.A N GLY 198.A O no hydrogen 3.014 N/A TYR 203.A N ILE 199.A O no hydrogen 3.075 N/A TYR 203.A OH THR 184.A O no hydrogen 2.701 N/A ARG 204.A N.A VAL 200.A O no hydrogen 3.204 N/A ARG 204.A N.B VAL 200.A O no hydrogen 3.139 N/A ARG 204.A NH1.A ASP 261.A OD1 no hydrogen 3.180 N/A ARG 204.A NH2.A ASP 261.A OD1 no hydrogen 2.660 N/A ARG 204.A NH2.B ASP 261.A OD1 no hydrogen 3.531 N/A ALA 205.A N ASP 201.A O no hydrogen 2.965 N/A THR 206.A N ASP 202.A O no hydrogen 2.900 N/A THR 206.A OG1 PRO 155.A O no hydrogen 2.685 N/A THR 206.A OG1 ASP 202.A O no hydrogen 3.187 N/A PHE 207.A N TYR 203.A O no hydrogen 2.933 N/A ALA 208.A N ARG 204.A O.A no hydrogen 3.308 N/A ALA 208.A N ARG 204.A O.B no hydrogen 3.326 N/A LYS 209.A N ALA 205.A O no hydrogen 2.924 N/A LYS 209.A NZ GLU 138.A OE1 no hydrogen 3.328 N/A LYS 209.A NZ GLU 138.A OE2 no hydrogen 3.356 N/A ALA 210.A N THR 206.A O no hydrogen 2.891 N/A LYS 211.A N PHE 207.A O no hydrogen 3.133 N/A LYS 211.A NZ THR 254.A OG1 no hydrogen 3.397 N/A ALA 212.A N ALA 208.A O no hydrogen 3.237 N/A ALA 212.A N LYS 209.A O no hydrogen 3.063 N/A MET 213.A N ALA 210.A O no hydrogen 3.320 N/A ASP 216.A N GLU 176.A O no hydrogen 2.807 N/A VAL 217.A N GLU 176.A O no hydrogen 3.022 N/A LEU 219.A N LEU 178.A O no hydrogen 2.872 N/A GLY 220.A N TYR 38.A OH no hydrogen 3.421 N/A HIS 222.A ND1 GLY 34.A O no hydrogen 2.815 N/A GLU 224.A N.A GLU 224.A OE1.A no hydrogen 2.818 N/A GLU 224.A N.B GLU 224.A OE1.B no hydrogen 2.851 N/A VAL 225.A N HIS 222.A O no hydrogen 3.041 N/A TYR 226.A N PRO 223.A O no hydrogen 3.201 N/A TYR 226.A OH TYR 38.A OH no hydrogen 2.723 N/A MET 228.A N PRO 223.A O no hydrogen 3.125 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 2.806 N/A GLN 229.A NE2 ASP 33.A OD1 no hydrogen 3.090 N/A LYS 231.A N GLY 227.A O no hydrogen 3.269 N/A LYS 231.A NZ TYR 226.A O no hydrogen 2.771 N/A LYS 231.A NZ GLU 248.A OE1 no hydrogen 2.683 N/A LYS 231.A NZ GLU 248.A OE2 no hydrogen 3.309 N/A ARG 232.A N MET 228.A O no hydrogen 2.882 N/A ALA 233.A N GLN 229.A O no hydrogen 3.157 N/A GLU 234.A N LYS 231.A O no hydrogen 2.965 N/A MET 235.A N ARG 232.A O no hydrogen 3.131 N/A ALA 239.A N LYS 236.A O no hydrogen 3.013 N/A ASN 241.A ND2 LEU 23.A O no hydrogen 2.928 N/A PHE 243.A N ASN 241.A OD1 no hydrogen 2.844 N/A ILE 244.A N ASN 241.A O no hydrogen 3.176 N/A LYS 245.A N ASP 216.A O no hydrogen 2.872 N/A GLU 248.A N LYS 245.A O no hydrogen 3.104 N/A THR 251.A N GLY 247.A O no hydrogen 3.267 N/A THR 251.A OG1 GLY 247.A O no hydrogen 3.389 N/A TYR 252.A N GLU 248.A O no hydrogen 2.802 N/A ALA 253.A N LEU 249.A O no hydrogen 2.848 N/A THR 254.A N VAL 250.A O no hydrogen 3.043 N/A THR 254.A OG1 VAL 250.A O no hydrogen 2.757 N/A SER 255.A N THR 251.A O no hydrogen 3.032 N/A SER 255.A OG THR 251.A O no hydrogen 3.246 N/A LEU 256.A N TYR 252.A O no hydrogen 2.867 N/A SER 257.A N ALA 253.A O no hydrogen 2.882 N/A SER 257.A OG.B ALA 253.A O no hydrogen 3.430 N/A SER 257.A OG.B THR 254.A O no hydrogen 2.895 N/A GLU 258.A N THR 254.A O no hydrogen 3.030 N/A ASP 259.A N SER 255.A O no hydrogen 3.054 N/A PHE 260.A N LEU 256.A O no hydrogen 2.809 N/A ASP 261.A N SER 257.A O no hydrogen 3.014 N/A LYS 262.A N GLU 258.A O no hydrogen 3.218 N/A GLN 263.A N ASP 259.A O no hydrogen 2.877 N/A GLN 263.A NE2 ASP 259.A OD1 no hydrogen 3.249 N/A LEU 264.A N PHE 260.A O no hydrogen 2.802 N/A ALA 265.A N ASP 261.A O no hydrogen 3.078 N/A LYS 266.A N LYS 262.A O no hydrogen 2.955 N/A GLN 267.A N GLN 263.A O no hydrogen 2.891 N/A GLN 267.A NE2 ASN 188.A O no hydrogen 3.092 N/A THR 268.A N LEU 264.A O no hydrogen 2.903 N/A THR 268.A OG1 LEU 264.A O no hydrogen 2.734 N/A ALA 269.A N ALA 265.A O no hydrogen 2.933 N/A ALA 270.A N LYS 266.A O no hydrogen 2.955 N/A LEU 271.A N GLN 267.A O no hydrogen 3.189 N/A LEU 271.A N THR 268.A O no hydrogen 3.224 N/A GLU 272.A N ALA 269.A O no hydrogen 3.205 N/A