Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s8l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ILE 1.A O no hydrogen 3.082 N/A ILE 8.A N ARG 4.A O no hydrogen 3.086 N/A TRP 9.A N PRO 5.A O no hydrogen 2.927 N/A LEU 10.A N GLU 6.A O no hydrogen 3.246 N/A ALA 11.A N TRP 7.A O no hydrogen 2.825 N/A LEU 12.A N ILE 8.A O no hydrogen 2.857 N/A GLY 13.A N TRP 9.A O no hydrogen 3.003 N/A THR 14.A N LEU 10.A O no hydrogen 3.126 N/A THR 14.A OG1 LEU 10.A O no hydrogen 2.681 N/A ALA 15.A N ALA 11.A O no hydrogen 3.078 N/A LEU 16.A N LEU 12.A O no hydrogen 2.888 N/A MET 17.A N GLY 13.A O no hydrogen 2.964 N/A GLY 18.A N THR 14.A O no hydrogen 2.970 N/A LEU 19.A N ALA 15.A O no hydrogen 2.831 N/A GLY 20.A N LEU 16.A O no hydrogen 2.968 N/A THR 21.A N MET 17.A O no hydrogen 3.014 N/A THR 21.A OG1 MET 17.A O no hydrogen 2.634 N/A LEU 22.A N GLY 18.A O no hydrogen 3.081 N/A TYR 23.A N LEU 19.A O no hydrogen 2.925 N/A PHE 24.A N GLY 20.A O no hydrogen 2.887 N/A LEU 25.A N THR 21.A O no hydrogen 2.898 N/A VAL 26.A N LEU 22.A O no hydrogen 2.890 N/A LYS 27.A N TYR 23.A O no hydrogen 2.863 N/A LYS 27.A NZ TYR 40.A OH no hydrogen 3.241 N/A LYS 27.A NZ LEU 211.A O no hydrogen 2.934 N/A GLY 28.A N PHE 24.A O no hydrogen 2.854 N/A MET 29.A N LEU 25.A O no hydrogen 3.218 N/A MET 29.A N VAL 26.A O no hydrogen 3.285 N/A VAL 31.A N GLY 28.A O no hydrogen 3.280 N/A ALA 36.A N ASP 33.A OD2 no hydrogen 3.116 N/A LYS 37.A N ASP 33.A O no hydrogen 3.001 N/A LYS 37.A NZ GLY 28.A O no hydrogen 2.977 N/A LYS 38.A N ASP 35.A O no hydrogen 3.141 N/A PHE 39.A N ASP 35.A O no hydrogen 3.469 N/A TYR 40.A N ALA 36.A O no hydrogen 3.013 N/A ALA 41.A N LYS 37.A O no hydrogen 2.967 N/A ILE 42.A N LYS 38.A O no hydrogen 3.208 N/A THR 43.A N PHE 39.A O no hydrogen 2.913 N/A THR 43.A OG1 PHE 39.A O no hydrogen 2.616 N/A THR 43.A OG1 ASP 83.A OD1 no hydrogen 2.739 N/A THR 43.A OG1 ASP 83.A OD2 no hydrogen 3.449 N/A THR 44.A N TYR 40.A O no hydrogen 3.014 N/A THR 44.A OG1 TYR 40.A O no hydrogen 2.600 N/A LEU 45.A N ALA 41.A O no hydrogen 3.113 N/A VAL 46.A N ILE 42.A O no hydrogen 3.117 N/A ILE 49.A N LEU 45.A O no hydrogen 2.964 N/A ALA 50.A N VAL 46.A O no hydrogen 3.280 N/A PHE 51.A N PRO 47.A O no hydrogen 2.860 N/A THR 52.A N ALA 48.A O no hydrogen 3.122 N/A THR 52.A OG1 ALA 48.A O no hydrogen 3.002 N/A MET 53.A N ILE 49.A O no hydrogen 2.986 N/A TYR 54.A N ALA 50.A O no hydrogen 2.845 N/A TYR 54.A OH ASP 199.A OD1 no hydrogen 2.712 N/A LEU 55.A N PHE 51.A O no hydrogen 2.890 N/A SER 56.A N THR 52.A O no hydrogen 3.018 N/A SER 56.A OG THR 52.A O no hydrogen 3.407 N/A SER 56.A OG MET 53.A O no hydrogen 2.637 N/A MET 57.A N MET 53.A O no hydrogen 3.002 N/A LEU 58.A N TYR 54.A O no hydrogen 3.108 N/A LEU 59.A N LEU 55.A O no hydrogen 2.914 N/A GLY 60.A N SER 56.A O no hydrogen 2.847 N/A TYR 61.A N LEU 58.A O no hydrogen 3.303 N/A TYR 66.A N ASN 63.A O no hydrogen 3.365 N/A TYR 66.A OH GLU 6.A OE2 no hydrogen 2.747 N/A TRP 67.A N PRO 64.A O no hydrogen 3.127 N/A ALA 68.A N ILE 65.A O no hydrogen 3.343 N/A TYR 70.A N.A TYR 66.A O no hydrogen 3.223 N/A TYR 70.A N.B TYR 66.A O no hydrogen 3.218 N/A TYR 70.A OH.A ILE 106.A O no hydrogen 2.464 N/A ALA 71.A N TRP 67.A O no hydrogen 2.985 N/A SER 72.A N ALA 68.A O no hydrogen 3.087 N/A SER 72.A OG ARG 69.A O no hydrogen 2.511 N/A TRP 73.A N ARG 69.A O no hydrogen 3.103 N/A TRP 73.A NE1 ASP 199.A OD2 no hydrogen 2.935 N/A LEU 74.A N TYR 70.A O.A no hydrogen 3.057 N/A LEU 74.A N TYR 70.A O.B no hydrogen 3.067 N/A PHE 75.A N ALA 71.A O no hydrogen 3.215 N/A THR 76.A N SER 72.A O no hydrogen 2.821 N/A THR 76.A OG1 SER 72.A O no hydrogen 2.664 N/A THR 77.A N TRP 73.A O no hydrogen 2.978 N/A THR 77.A OG1 TRP 73.A O no hydrogen 2.620 N/A THR 77.A OG1 ASP 102.A OD1 no hydrogen 3.132 N/A THR 77.A OG1 ASP 102.A OD2 no hydrogen 2.725 N/A LEU 80.A N THR 76.A O no hydrogen 2.939 N/A LEU 81.A N THR 77.A O no hydrogen 3.059 N/A LEU 82.A N PRO 78.A O no hydrogen 2.888 N/A ASP 83.A N LEU 79.A O no hydrogen 2.978 N/A LEU 84.A N LEU 80.A O no hydrogen 3.248 N/A ALA 85.A N LEU 81.A O no hydrogen 2.845 N/A LEU 86.A N LEU 82.A O no hydrogen 2.776 N/A LEU 87.A N ASP 83.A O no hydrogen 3.101 N/A VAL 88.A N LEU 84.A O no hydrogen 3.238 N/A ASP 89.A N LEU 86.A O no hydrogen 3.321 N/A ALA 90.A N ALA 85.A O no hydrogen 2.940 N/A THR 94.A N ASP 91.A OD2 no hydrogen 2.953 N/A THR 94.A OG1 ASP 91.A O no hydrogen 2.916 N/A ILE 95.A N ASP 91.A O no hydrogen 3.185 N/A LEU 96.A N GLN 92.A O no hydrogen 2.892 N/A ALA 97.A N GLY 93.A O no hydrogen 3.211 N/A LEU 98.A N THR 94.A O no hydrogen 2.924 N/A VAL 99.A N ILE 95.A O no hydrogen 2.982 N/A GLY 100.A N LEU 96.A O no hydrogen 2.878 N/A ALA 101.A N ALA 97.A O no hydrogen 2.926 N/A ASP 102.A N LEU 98.A O no hydrogen 2.851 N/A GLY 103.A N VAL 99.A O no hydrogen 2.939 N/A ILE 104.A N GLY 100.A O no hydrogen 3.238 N/A MET 105.A N ALA 101.A O no hydrogen 2.871 N/A ILE 106.A N ASP 102.A O no hydrogen 2.939 N/A GLY 107.A N GLY 103.A O no hydrogen 2.763 N/A THR 108.A N ILE 104.A O no hydrogen 2.863 N/A THR 108.A OG1 ILE 104.A O no hydrogen 2.655 N/A GLY 109.A N MET 105.A O no hydrogen 3.207 N/A LEU 110.A N ILE 106.A O no hydrogen 3.185 N/A VAL 111.A N GLY 107.A O no hydrogen 3.151 N/A GLY 112.A N THR 108.A O no hydrogen 2.832 N/A ALA 113.A N GLY 109.A O no hydrogen 3.124 N/A ALA 113.A N LEU 110.A O no hydrogen 3.029 N/A LEU 114.A N LEU 110.A O no hydrogen 3.091 N/A LEU 114.A N VAL 111.A O no hydrogen 3.098 N/A THR 115.A N VAL 111.A O no hydrogen 3.147 N/A THR 115.A OG1 VAL 117.A O no hydrogen 3.538 N/A VAL 117.A N THR 115.A OG1 no hydrogen 3.199 N/A SER 119.A OG TYR 118.A O no hydrogen 2.555 N/A TYR 120.A N VAL 117.A O no hydrogen 3.217 N/A ARG 121.A NH1 SER 180.A O no hydrogen 3.136 N/A ARG 121.A NH1 GLY 182.A O no hydrogen 2.909 N/A PHE 122.A N SER 119.A O no hydrogen 3.311 N/A VAL 123.A N TYR 120.A O no hydrogen 2.866 N/A TRP 124.A N TYR 120.A O no hydrogen 3.070 N/A TRP 125.A N ARG 121.A O no hydrogen 3.127 N/A TRP 125.A NE1 PRO 173.A O no hydrogen 2.933 N/A ALA 126.A N PHE 122.A O no hydrogen 2.911 N/A ILE 127.A N VAL 123.A O no hydrogen 3.122 N/A SER 128.A N TRP 124.A O no hydrogen 2.964 N/A SER 128.A OG MET 105.A O no hydrogen 2.772 N/A THR 129.A N TRP 125.A O no hydrogen 2.933 N/A THR 129.A OG1 TRP 125.A O no hydrogen 2.855 N/A ALA 130.A N ALA 126.A O no hydrogen 2.986 N/A ALA 131.A N ILE 127.A O no hydrogen 3.055 N/A MET 132.A N SER 128.A O no hydrogen 2.923 N/A LEU 133.A N THR 129.A O no hydrogen 2.802 N/A TYR 134.A N ALA 130.A O no hydrogen 3.142 N/A ILE 135.A N ALA 131.A O no hydrogen 3.205 N/A LEU 136.A N MET 132.A O no hydrogen 2.926 N/A TYR 137.A N LEU 133.A O no hydrogen 2.878 N/A VAL 138.A N TYR 134.A O no hydrogen 2.949 N/A LEU 139.A N ILE 135.A O no hydrogen 2.937 N/A PHE 140.A N LEU 136.A O no hydrogen 2.840 N/A PHE 141.A N TYR 137.A O no hydrogen 2.993 N/A PHE 143.A N VAL 138.A O no hydrogen 2.849 N/A THR 144.A OG1 PHE 140.A O no hydrogen 2.551 N/A SER 145.A OG PHE 141.A O no hydrogen 3.139 N/A LYS 146.A NZ VAL 88.A O no hydrogen 2.828 N/A ALA 147.A N PHE 143.A O no hydrogen 2.831 N/A GLU 148.A N THR 144.A O no hydrogen 2.890 N/A SER 149.A N LYS 146.A O no hydrogen 3.377 N/A SER 149.A OG LYS 146.A O no hydrogen 2.760 N/A MET 150.A N ALA 147.A O no hydrogen 3.016 N/A ARG 151.A NH1 GLU 153.A OE1 no hydrogen 3.301 N/A ARG 151.A NH1 ARG 214.A O no hydrogen 3.200 N/A ARG 151.A NH1 PHE 217.A O no hydrogen 3.331 N/A ARG 151.A NH2 PHE 217.A O no hydrogen 2.732 N/A ALA 155.A N ARG 151.A O no hydrogen 3.050 N/A SER 156.A N PRO 152.A O no hydrogen 2.917 N/A THR 157.A N GLU 153.A O no hydrogen 3.067 N/A THR 157.A OG1 GLU 153.A O no hydrogen 2.992 N/A THR 157.A OG1 SER 213.A OG no hydrogen 2.581 N/A PHE 158.A N VAL 154.A O no hydrogen 2.881 N/A LYS 159.A N ALA 155.A O no hydrogen 3.153 N/A LYS 159.A NZ GLU 148.A OE2 no hydrogen 3.490 N/A VAL 160.A N SER 156.A O no hydrogen 3.432 N/A LEU 161.A N THR 157.A O no hydrogen 3.001 N/A ARG 162.A N PHE 158.A O no hydrogen 2.642 N/A ARG 162.A NE THR 144.A OG1 no hydrogen 3.240 N/A ARG 162.A NH1 ASN 163.A OD1 no hydrogen 2.832 N/A ARG 162.A NH2 THR 144.A OG1 no hydrogen 3.158 N/A ASN 163.A N LYS 159.A O no hydrogen 2.962 N/A VAL 164.A N VAL 160.A O no hydrogen 3.031 N/A THR 165.A N LEU 161.A O no hydrogen 2.891 N/A THR 165.A OG1 LEU 161.A O no hydrogen 2.820 N/A VAL 166.A N ARG 162.A O no hydrogen 2.891 N/A VAL 167.A N ASN 163.A O no hydrogen 3.082 N/A LEU 168.A N VAL 164.A O no hydrogen 2.997 N/A TRP 169.A N THR 165.A O no hydrogen 2.882 N/A SER 170.A N VAL 166.A O no hydrogen 3.157 N/A SER 170.A OG VAL 166.A O no hydrogen 2.645 N/A ALA 171.A N LEU 168.A O no hydrogen 3.161 N/A TYR 172.A N TRP 169.A O no hydrogen 3.312 N/A TYR 172.A OH ASP 199.A OD2 no hydrogen 2.864 N/A VAL 175.A N ALA 171.A O no hydrogen 2.978 N/A TRP 176.A N TYR 172.A O no hydrogen 2.916 N/A TRP 176.A NE1 TYR 70.A OH.B no hydrogen 2.696 N/A LEU 177.A N PRO 173.A O no hydrogen 2.918 N/A ILE 178.A N VAL 174.A O no hydrogen 3.106 N/A GLY 179.A N TRP 176.A O no hydrogen 3.140 N/A SER 180.A N GLU 191.A OE2 no hydrogen 3.218 N/A SER 180.A OG GLU 191.A OE2 no hydrogen 2.988 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.879 N/A GLY 182.A N GLY 179.A O no hydrogen 3.051 N/A ALA 183.A N LEU 177.A O no hydrogen 2.664 N/A GLY 184.A N GLY 179.A O no hydrogen 2.743 N/A ILE 185.A N ILE 178.A O no hydrogen 2.938 N/A VAL 186.A N ILE 178.A O no hydrogen 2.892 N/A ILE 190.A N PRO 187.A O no hydrogen 3.283 N/A GLU 191.A N PRO 187.A O no hydrogen 3.072 N/A THR 192.A N LEU 188.A O no hydrogen 2.847 N/A THR 192.A OG1 TYR 66.A OH no hydrogen 2.925 N/A THR 192.A OG1 LEU 188.A O no hydrogen 2.898 N/A LEU 193.A N ASN 189.A O no hydrogen 3.280 N/A LEU 194.A N ILE 190.A O no hydrogen 2.994 N/A PHE 195.A N GLU 191.A O no hydrogen 3.085 N/A MET 196.A N THR 192.A O no hydrogen 3.227 N/A VAL 197.A N LEU 193.A O no hydrogen 3.036 N/A LEU 198.A N LEU 194.A O no hydrogen 2.907 N/A ASP 199.A N PHE 195.A O no hydrogen 2.728 N/A VAL 200.A N MET 196.A O no hydrogen 2.979 N/A SER 201.A N VAL 197.A O no hydrogen 3.083 N/A SER 201.A OG VAL 197.A O no hydrogen 2.702 N/A ALA 202.A N LEU 198.A O no hydrogen 2.952 N/A LYS 203.A N ASP 199.A O no hydrogen 3.071 N/A LYS 203.A N VAL 200.A O no hydrogen 3.289 N/A VAL 204.A N VAL 200.A O no hydrogen 2.720 N/A GLY 205.A N VAL 200.A O no hydrogen 3.059 N/A PHE 206.A N SER 201.A O no hydrogen 2.951 N/A GLY 207.A N LYS 203.A O no hydrogen 2.979 N/A LEU 208.A N VAL 204.A O no hydrogen 2.854 N/A ILE 209.A N GLY 205.A O no hydrogen 3.268 N/A LEU 210.A N PHE 206.A O no hydrogen 3.111 N/A LEU 211.A N GLY 207.A O no hydrogen 2.846 N/A ARG 212.A N LEU 208.A O no hydrogen 3.029 N/A ARG 212.A NH2 TYR 23.A OH no hydrogen 2.857 N/A SER 213.A N LEU 210.A O no hydrogen 3.118 N/A SER 213.A OG THR 157.A OG1 no hydrogen 2.581 N/A ARG 214.A NH1 GLU 219.A OE1 no hydrogen 3.017 N/A ALA 215.A N SER 213.A OG no hydrogen 2.997 N/A PHE 217.A N ARG 214.A O no hydrogen 3.274 N/A GLY 218.A N ASP 33.A OD2 no hydrogen 3.122 N/A