Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5thk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N THR 3.A OG1 no hydrogen 3.273 N/A LYS 7.A N LEU 4.A O no hydrogen 3.027 N/A VAL 8.A N ASP 89.A OD2 no hydrogen 2.923 N/A VAL 9.A N ALA 33.A O no hydrogen 2.916 N/A LEU 10.A N ILE 90.A O no hydrogen 2.838 N/A ILE 11.A N ALA 35.A O no hydrogen 3.018 N/A ALA 12.A N ILE 92.A O no hydrogen 2.899 N/A GLY 13.A N HIS 37.A ND1 no hydrogen 2.920 N/A GLY 14.A N HIS 37.A O no hydrogen 2.937 N/A LYS 16.A NZ SER 43.A OG no hydrogen 3.274 N/A GLY 20.A N LYS 16.A O no hydrogen 2.944 N/A LEU 21.A N ASN 17.A O no hydrogen 3.209 N/A ILE 22.A N LEU 18.A O no hydrogen 2.919 N/A ALA 23.A N GLY 19.A O no hydrogen 2.935 N/A ARG 24.A N GLY 20.A O no hydrogen 3.242 N/A ARG 24.A NH1 GLY 20.A O no hydrogen 3.061 N/A ARG 24.A NH1 THR 50.A OG1 no hydrogen 2.837 N/A ASP 25.A N LEU 21.A O no hydrogen 2.818 N/A LEU 26.A N ILE 22.A O no hydrogen 2.848 N/A ALA 27.A N ALA 23.A O no hydrogen 3.115 N/A GLY 28.A N ARG 24.A O no hydrogen 2.927 N/A HIS 29.A N ASP 25.A O no hydrogen 2.998 N/A HIS 29.A ND1 ASP 25.A O no hydrogen 2.916 N/A GLY 30.A N ALA 27.A O no hydrogen 3.013 N/A ALA 31.A N LEU 26.A O no hydrogen 3.012 N/A LYS 32.A N LYS 7.A O no hydrogen 2.839 N/A LYS 32.A NZ ASP 6.A OD1 no hydrogen 2.984 N/A ALA 33.A N LYS 7.A O no hydrogen 3.465 N/A VAL 34.A N GLU 60.A O no hydrogen 2.923 N/A ALA 35.A N VAL 9.A O no hydrogen 2.725 N/A ILE 36.A N ALA 62.A O no hydrogen 2.810 N/A HIS 37.A N ILE 11.A O no hydrogen 3.018 N/A HIS 37.A NE2 ALA 66.A O no hydrogen 2.806 N/A TYR 38.A N PHE 64.A O no hydrogen 3.081 N/A SER 43.A N SER 40.A O no hydrogen 2.910 N/A GLN 44.A N ALA 41.A O no hydrogen 3.104 N/A ALA 47.A N SER 43.A O no hydrogen 2.975 N/A GLU 48.A N GLN 44.A O no hydrogen 2.942 N/A GLU 49.A N ALA 45.A O no hydrogen 2.962 N/A THR 50.A N GLN 46.A O no hydrogen 2.822 N/A THR 50.A OG1 ALA 15.A O no hydrogen 2.746 N/A THR 50.A OG1 GLN 46.A O no hydrogen 2.983 N/A ALA 51.A N ALA 47.A O no hydrogen 2.920 N/A ALA 52.A N GLU 48.A O no hydrogen 2.968 N/A ALA 53.A N GLU 49.A O no hydrogen 2.867 N/A VAL 54.A N THR 50.A O no hydrogen 2.845 N/A ARG 55.A N ALA 51.A O no hydrogen 3.005 N/A ARG 55.A NH2 ALA 61.A O no hydrogen 3.032 N/A ALA 56.A N ALA 52.A O no hydrogen 2.988 N/A ALA 57.A N ALA 53.A O no hydrogen 2.935 N/A GLY 58.A N ARG 55.A O no hydrogen 3.069 N/A ALA 59.A N VAL 54.A O no hydrogen 3.110 N/A GLU 60.A N LYS 32.A O no hydrogen 2.973 N/A ALA 62.A N VAL 34.A O no hydrogen 3.303 N/A THR 63.A OG1 GLU 48.A OE2 no hydrogen 2.797 N/A PHE 64.A N ILE 36.A O no hydrogen 2.871 N/A GLN 65.A NE2 ASN 39.A O no hydrogen 2.952 N/A ALA 66.A N TYR 38.A O no hydrogen 3.007 N/A THR 69.A N ASP 67.A OD1 no hydrogen 3.066 N/A THR 69.A OG1 ASP 67.A OD1 no hydrogen 2.679 N/A ALA 73.A N THR 70.A OG1 no hydrogen 3.288 N/A VAL 74.A N THR 70.A O no hydrogen 3.370 N/A GLU 75.A N ALA 71.A O no hydrogen 3.094 N/A LYS 76.A N ALA 72.A O no hydrogen 2.875 N/A LYS 76.A NZ ASP 80.A OD2 no hydrogen 2.930 N/A LEU 77.A N ALA 73.A O no hydrogen 2.971 N/A PHE 78.A N VAL 74.A O no hydrogen 3.153 N/A ASP 79.A N GLU 75.A O no hydrogen 2.885 N/A ASP 80.A N LYS 76.A O no hydrogen 2.790 N/A ALA 81.A N LEU 77.A O no hydrogen 2.923 N/A LYS 82.A N PHE 78.A O no hydrogen 2.913 N/A GLN 83.A N ASP 79.A O no hydrogen 2.899 N/A ARG 84.A N ASP 80.A O no hydrogen 3.023 N/A ARG 84.A NH1 ARG 84.A O no hydrogen 2.939 N/A PHE 85.A N ALA 81.A O no hydrogen 2.985 N/A GLY 86.A N LYS 82.A O no hydrogen 2.700 N/A LYS 87.A NZ ASP 6.A O no hydrogen 2.658 N/A LYS 87.A NZ ASP 6.A OD2 no hydrogen 3.249 N/A LYS 87.A NZ ASP 89.A OD2 no hydrogen 2.739 N/A ASP 89.A N VAL 8.A O no hydrogen 2.906 N/A ILE 90.A N VAL 8.A O no hydrogen 3.097 N/A ALA 91.A N LYS 138.A O no hydrogen 2.880 N/A ILE 92.A N LEU 10.A O no hydrogen 2.898 N/A ASN 93.A N VAL 140.A O no hydrogen 2.829 N/A THR 94.A N ALA 12.A O no hydrogen 2.988 N/A THR 94.A OG1 ALA 12.A O no hydrogen 2.941 N/A THR 94.A OG1 GLY 13.A O no hydrogen 3.133 N/A VAL 95.A N ASN 93.A OD1 no hydrogen 2.883 N/A LYS 97.A N ASN 118.A OD1 no hydrogen 2.954 N/A LYS 100.A NZ TYR 154.A OH no hydrogen 3.387 N/A LYS 100.A NZ GLU 199.A OE1 no hydrogen 2.867 N/A LYS 101.A N PHE 153.A O no hydrogen 2.880 N/A LYS 101.A NZ GLU 110.A OE1 no hydrogen 2.787 N/A LYS 101.A NZ GLU 110.A OE2 no hydrogen 3.311 N/A GLU 105.A N PRO 102.A O no hydrogen 2.929 N/A ILE 106.A N PHE 103.A O no hydrogen 3.225 N/A SER 107.A N GLU 110.A OE2 no hydrogen 2.972 N/A SER 107.A OG GLU 110.A OE2 no hydrogen 2.888 N/A GLU 110.A N SER 107.A OG no hydrogen 3.090 N/A TYR 111.A N SER 107.A O no hydrogen 2.927 N/A ASP 112.A N GLU 108.A O no hydrogen 2.819 N/A GLU 113.A N ALA 109.A O no hydrogen 3.089 N/A MET 114.A N GLU 110.A O no hydrogen 2.996 N/A PHE 115.A N TYR 111.A O no hydrogen 2.955 N/A ALA 116.A N ASP 112.A O no hydrogen 2.931 N/A VAL 117.A N GLU 113.A O no hydrogen 2.952 N/A ASN 118.A N MET 114.A O no hydrogen 2.912 N/A ASN 118.A ND2 LYS 97.A O no hydrogen 2.855 N/A ASN 118.A ND2 MET 114.A O no hydrogen 3.195 N/A ASN 118.A ND2 SER 160.A OG no hydrogen 2.946 N/A SER 119.A N PHE 115.A O no hydrogen 2.990 N/A LYS 120.A N PHE 115.A O no hydrogen 2.904 N/A SER 121.A N ALA 116.A O no hydrogen 2.998 N/A SER 121.A OG.A VAL 117.A O no hydrogen 2.503 N/A SER 121.A OG.B LEU 68.A O no hydrogen 3.097 N/A PHE 123.A N SER 119.A O no hydrogen 2.873 N/A PHE 124.A N LYS 120.A O no hydrogen 3.052 N/A PHE 125.A N SER 121.A O no hydrogen 2.914 N/A ILE 126.A N ALA 122.A O no hydrogen 3.023 N/A LYS 127.A N PHE 123.A O no hydrogen 2.847 N/A GLU 128.A N PHE 124.A O no hydrogen 2.805 N/A ALA 129.A N PHE 125.A O no hydrogen 2.874 N/A GLY 130.A N ILE 126.A O no hydrogen 3.031 N/A ARG 131.A N LYS 127.A O no hydrogen 3.128 N/A HIS 132.A N ALA 129.A O no hydrogen 3.218 N/A HIS 132.A ND1 GLU 128.A O no hydrogen 2.778 N/A HIS 132.A NE2 ASP 79.A OD1 no hydrogen 2.702 N/A LEU 133.A N ALA 129.A O no hydrogen 2.817 N/A GLU 134.A N ILE 88.A O no hydrogen 2.994 N/A HIS 136.A N ARG 178.A O no hydrogen 2.867 N/A GLY 137.A N GLU 134.A O no hydrogen 3.109 N/A LYS 138.A N ASP 89.A O no hydrogen 2.938 N/A LYS 138.A NZ HIS 136.A O no hydrogen 2.932 N/A LEU 139.A N SER 181.A O no hydrogen 2.951 N/A VAL 140.A N ALA 91.A O no hydrogen 3.024 N/A THR 141.A N THR 183.A O no hydrogen 3.024 N/A LEU 142.A N ASN 93.A O no hydrogen 2.963 N/A VAL 143.A N VAL 185.A O no hydrogen 2.769 N/A SER 145.A N PRO 187.A O no hydrogen 3.019 N/A SER 145.A OG GLY 186.A O no hydrogen 2.809 N/A LEU 146.A N THR 144.A OG1 no hydrogen 2.898 N/A LEU 147.A N THR 144.A O no hydrogen 3.127 N/A GLY 148.A N SER 145.A O no hydrogen 2.968 N/A ALA 149.A N LEU 146.A O no hydrogen 2.995 N/A TYR 154.A OH GLU 199.A OE1 no hydrogen 3.090 N/A TYR 154.A OH GLU 199.A OE2 no hydrogen 2.631 N/A TYR 154.A OH HIS 207.A NE2 no hydrogen 3.381 N/A TYR 157.A N TYR 154.A O no hydrogen 2.984 N/A GLU 158.A N TYR 154.A O no hydrogen 2.837 N/A GLY 159.A N ALA 155.A O no hydrogen 2.987 N/A SER 160.A N TYR 157.A O no hydrogen 3.176 N/A SER 160.A OG MET 114.A O no hydrogen 3.558 N/A SER 160.A OG ALA 156.A O no hydrogen 2.652 N/A SER 160.A OG TYR 157.A O no hydrogen 3.374 N/A LYS 161.A N TYR 157.A O no hydrogen 3.019 N/A LYS 161.A NZ VAL 95.A O no hydrogen 3.317 N/A LYS 161.A NZ ASN 118.A OD1 no hydrogen 3.467 N/A LYS 161.A NZ LEU 142.A O no hydrogen 3.053 N/A ALA 162.A N GLU 158.A O no hydrogen 3.057 N/A VAL 164.A N LYS 161.A O no hydrogen 2.975 N/A GLU 165.A N ALA 162.A O no hydrogen 3.194 N/A PHE 167.A N PRO 163.A O no hydrogen 2.770 N/A THR 168.A N VAL 164.A O no hydrogen 2.862 N/A THR 168.A OG1 VAL 164.A O no hydrogen 2.791 N/A ARG 169.A N GLU 165.A O no hydrogen 3.134 N/A ARG 169.A NH2 GLU 165.A OE2 no hydrogen 3.171 N/A ALA 170.A N HIS 166.A O no hydrogen 3.104 N/A ALA 171.A N PHE 167.A O no hydrogen 2.894 N/A SER 172.A N THR 168.A O no hydrogen 2.917 N/A SER 172.A OG.A THR 168.A O no hydrogen 3.392 N/A SER 172.A OG.A ARG 169.A O no hydrogen 2.753 N/A SER 172.A OG.B THR 242.A OG1 no hydrogen 2.976 N/A LYS 173.A N ARG 169.A O no hydrogen 3.247 N/A GLU 174.A N ALA 170.A O no hydrogen 2.899 N/A TYR 175.A N ALA 171.A O no hydrogen 2.763 N/A TYR 175.A OH ILE 126.A O no hydrogen 2.776 N/A ARG 178.A N TYR 175.A O no hydrogen 3.072 N/A ARG 178.A NH1 LEU 133.A O no hydrogen 2.892 N/A ARG 178.A NH1 ASP 135.A OD1 no hydrogen 2.837 N/A ARG 178.A NH2 GLY 130.A O no hydrogen 2.868 N/A ARG 178.A NH2 LEU 133.A O no hydrogen 2.981 N/A GLY 179.A N GLY 176.A O no hydrogen 2.856 N/A ILE 180.A N TYR 175.A O no hydrogen 3.394 N/A SER 181.A N GLY 137.A O no hydrogen 3.093 N/A SER 181.A OG TRP 239.A O no hydrogen 2.587 N/A VAL 182.A N THR 242.A OG1 no hydrogen 2.962 N/A THR 183.A N LEU 139.A O no hydrogen 2.897 N/A ALA 184.A N GLN 244.A O no hydrogen 2.997 N/A VAL 185.A N THR 141.A O no hydrogen 2.923 N/A GLY 186.A N ILE 246.A O no hydrogen 2.805 N/A GLY 188.A N ILE 248.A O no hydrogen 3.191 N/A ASP 191.A N THR 222.A O no hydrogen 2.970 N/A THR 192.A N MET 190.A O no hydrogen 2.870 N/A PHE 194.A N THR 192.A OG1 no hydrogen 3.150 N/A PHE 195.A N THR 192.A O no hydrogen 3.119 N/A TYR 196.A OH ASP 191.A OD1 no hydrogen 2.616 N/A GLU 199.A N TYR 196.A O no hydrogen 3.149 N/A VAL 204.A N GLY 200.A O no hydrogen 2.859 N/A ALA 205.A N ALA 201.A O no hydrogen 3.045 N/A TYR 206.A N ASP 202.A O no hydrogen 3.014 N/A HIS 207.A N ALA 203.A O no hydrogen 2.846 N/A HIS 207.A NE2 GLU 199.A OE1 no hydrogen 2.982 N/A LYS 208.A N VAL 204.A O no hydrogen 2.872 N/A THR 209.A N TYR 206.A O no hydrogen 3.030 N/A THR 209.A OG1 ALA 205.A O no hydrogen 3.040 N/A THR 209.A OG1 TYR 206.A O no hydrogen 3.412 N/A ALA 210.A N HIS 207.A O no hydrogen 3.451 N/A ALA 211.A N SER 214.A OG.A no hydrogen 3.146 N/A ALA 212.A N GLY 251.A O no hydrogen 3.042 N/A LEU 213.A N GLY 250.A O no hydrogen 2.878 N/A SER 214.A N ALA 211.A O no hydrogen 2.996 N/A SER 214.A OG.A LYS 208.A O no hydrogen 3.262 N/A SER 214.A OG.A ALA 211.A O no hydrogen 3.121 N/A SER 214.A OG.A GLY 220.A O no hydrogen 2.911 N/A SER 214.A OG.B ALA 211.A O no hydrogen 2.954 N/A PHE 216.A N LEU 213.A O no hydrogen 2.888 N/A SER 217.A OG LEU 221.A O no hydrogen 2.765 N/A LYS 218.A N ASP 223.A OD2 no hydrogen 2.868 N/A LYS 218.A NZ GLU 225.A OE1 no hydrogen 2.795 N/A GLY 220.A N SER 217.A OG no hydrogen 2.962 N/A LEU 221.A N THR 219.A OG1 no hydrogen 3.228 N/A THR 222.A N PRO 189.A O no hydrogen 2.799 N/A GLU 225.A N GLU 225.A OE2 no hydrogen 2.862 N/A ASP 226.A N ASP 223.A O no hydrogen 2.945 N/A VAL 227.A N ILE 224.A O no hydrogen 2.948 N/A VAL 228.A N ILE 224.A O no hydrogen 3.072 N/A PHE 230.A N VAL 227.A O no hydrogen 3.058 N/A ILE 231.A N VAL 227.A O no hydrogen 3.252 N/A ARG 232.A N VAL 228.A O no hydrogen 2.886 N/A ARG 232.A NE.A ASP 25.A OD2 no hydrogen 2.675 N/A ARG 232.A NH2.A ASP 25.A OD1 no hydrogen 3.309 N/A ARG 232.A NH2.B ASP 25.A OD2 no hydrogen 2.890 N/A HIS 233.A N PRO 229.A O no hydrogen 2.915 N/A HIS 233.A ND1 ASP 237.A OD1 no hydrogen 2.840 N/A LEU 234.A N PHE 230.A O no hydrogen 2.904 N/A VAL 235.A N ILE 231.A O no hydrogen 3.111 N/A THR 236.A N HIS 233.A O no hydrogen 2.980 N/A THR 236.A OG1 ARG 232.A O no hydrogen 2.722 N/A THR 236.A OG1 HIS 233.A O no hydrogen 3.395 N/A THR 236.A OG1 ASP 237.A OD1 no hydrogen 3.362 N/A GLY 238.A N HIS 233.A O no hydrogen 2.792 N/A ILE 241.A N GLY 238.A O no hydrogen 2.961 N/A THR 242.A OG1 SER 172.A OG.B no hydrogen 2.976 N/A THR 242.A OG1 VAL 182.A O no hydrogen 3.439 N/A GLY 243.A N VAL 182.A O no hydrogen 2.741 N/A GLN 244.A NE2 THR 242.A O no hydrogen 3.074 N/A ILE 246.A N ALA 184.A O no hydrogen 2.920 N/A ILE 248.A N GLY 186.A O no hydrogen 3.022 N/A ASN 249.A ND2 SER 145.A OG no hydrogen 2.855 N/A ASN 249.A ND2 THR 253.A O no hydrogen 2.958 N/A GLY 251.A N ASN 249.A OD1 no hydrogen 2.897 N/A TYR 252.A N ASN 249.A OD1 no hydrogen 2.991 N/A TYR 252.A OH HIS 207.A ND1 no hydrogen 2.789 N/A THR 253.A OG1 SER 145.A O no hydrogen 2.775 N/A LYS 255.A N THR 254.A OG1 no hydrogen 2.786 N/A LYS 255.A NZ GLU 165.A OE2 no hydrogen 3.323 N/A LYS 255.A NZ THR 245.A O no hydrogen 2.933 N/A