Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qst_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 227.A OD1 no hydrogen 3.138 N/A ARG 1.A NE ASP 227.A OD2 no hydrogen 2.986 N/A ARG 1.A NH1 ASN 202.A O no hydrogen 2.901 N/A ARG 1.A NH2 ASP 227.A OD1 no hydrogen 3.005 N/A PHE 4.A N ASP 227.A O no hydrogen 2.896 N/A VAL 5.A N GLU 36.A O no hydrogen 2.877 N/A GLY 6.A N PHE 229.A O no hydrogen 2.895 N/A GLY 7.A N VAL 38.A O no hydrogen 2.811 N/A ASN 8.A N VAL 231.A O no hydrogen 2.834 N/A TRP 9.A N ALA 40.A O no hydrogen 2.940 N/A LYS 10.A N ASN 8.A OD1 no hydrogen 2.957 N/A LYS 10.A NZ GLU 95.A OE2 no hydrogen 2.696 N/A ASN 12.A ND2 TRP 9.A O no hydrogen 2.968 N/A THR 15.A OG1 GLU 18.A OE1 no hydrogen 2.776 N/A GLU 18.A N THR 15.A OG1 no hydrogen 3.092 N/A ALA 19.A N THR 15.A O no hydrogen 2.979 N/A GLU 20.A N VAL 16.A O no hydrogen 2.894 N/A LYS 21.A N GLN 17.A O no hydrogen 3.135 N/A LEU 22.A N GLU 18.A O no hydrogen 2.973 N/A VAL 23.A N ALA 19.A O no hydrogen 3.034 N/A GLU 24.A N GLU 20.A O no hydrogen 3.022 N/A MET 25.A N LYS 21.A O no hydrogen 3.082 N/A LEU 26.A N LEU 22.A O no hydrogen 2.924 N/A ASN 27.A N VAL 23.A O no hydrogen 2.862 N/A ASN 27.A ND2 LYS 52.A O no hydrogen 2.922 N/A GLY 28.A N MET 25.A O no hydrogen 3.262 N/A ALA 29.A N LEU 26.A O no hydrogen 3.094 N/A LYS 30.A NZ GLU 32.A OE2 no hydrogen 3.165 N/A GLU 32.A N ASN 245.A OD1 no hydrogen 2.819 N/A ASN 34.A N ASN 247.A OD1 no hydrogen 3.058 N/A GLU 36.A N PHE 3.A O no hydrogen 2.819 N/A VAL 38.A N VAL 5.A O no hydrogen 3.041 N/A VAL 39.A N LYS 58.A O no hydrogen 2.815 N/A ALA 40.A N GLY 7.A O no hydrogen 2.787 N/A ALA 41.A N SER 60.A O no hydrogen 3.348 N/A PHE 45.A N PRO 42.A O no hydrogen 2.887 N/A LEU 46.A N PHE 43.A O no hydrogen 3.077 N/A THR 48.A OG1 GLU 20.A OE2 no hydrogen 2.937 N/A LEU 49.A N PHE 45.A O no hydrogen 3.018 N/A GLN 50.A N LEU 46.A O no hydrogen 2.877 N/A GLN 51.A N PRO 47.A O no hydrogen 3.020 N/A LYS 52.A N THR 48.A O no hydrogen 2.878 N/A LYS 52.A NZ THR 48.A OG1 no hydrogen 2.814 N/A LYS 52.A NZ GLN 51.A OE1 no hydrogen 2.807 N/A LEU 53.A N LEU 49.A O no hydrogen 2.793 N/A ARG 54.A N ASN 27.A OD1 no hydrogen 2.728 N/A ARG 54.A NE ASP 56.A OD1 no hydrogen 2.871 N/A ARG 54.A NH1 LEU 26.A O no hydrogen 2.989 N/A ARG 54.A NH1 ALA 29.A O no hydrogen 2.783 N/A ARG 54.A NH2 ASP 56.A OD2 no hydrogen 3.024 N/A TRP 57.A N ARG 54.A O no hydrogen 3.203 N/A LYS 58.A N VAL 37.A O no hydrogen 3.095 N/A LYS 58.A NZ GLU 87.A OE1 no hydrogen 2.782 N/A SER 60.A N VAL 39.A O no hydrogen 2.775 N/A SER 60.A OG ALA 61.A O no hydrogen 2.814 N/A ALA 61.A N TRP 88.A O no hydrogen 2.923 N/A PHE 65.A N VAL 76.A O no hydrogen 2.963 N/A PHE 72.A N GLY 70.A O no hydrogen 2.840 N/A GLU 75.A N PHE 72.A O no hydrogen 2.976 N/A THR 77.A OG1 PRO 68.A O no hydrogen 2.646 N/A MET 80.A N THR 77.A O no hydrogen 3.072 N/A ILE 81.A N THR 77.A O no hydrogen 3.261 N/A LYS 82.A N VAL 78.A O no hydrogen 2.899 N/A SER 83.A N PRO 79.A O no hydrogen 2.982 N/A SER 83.A N MET 80.A O no hydrogen 3.301 N/A SER 83.A OG MET 80.A O no hydrogen 2.648 N/A PHE 84.A N ILE 81.A O no hydrogen 3.080 N/A GLY 85.A N LYS 82.A O no hydrogen 2.877 N/A ILE 86.A N ILE 81.A O no hydrogen 3.412 N/A THR 89.A N LYS 120.A O no hydrogen 3.047 N/A THR 89.A OG1 ALA 61.A O no hydrogen 3.558 N/A THR 89.A OG1 ILE 90.A O no hydrogen 2.984 N/A ILE 90.A N ALA 61.A O no hydrogen 2.964 N/A LEU 91.A N ILE 122.A O no hydrogen 2.879 N/A SER 94.A N GLU 165.A OE2 no hydrogen 2.765 N/A SER 94.A OG GLU 165.A OE1 no hydrogen 2.747 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 3.039 N/A ARG 96.A N HIS 93.A O no hydrogen 2.844 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.742 N/A ARG 96.A NH2 GLU 102.A OE2 no hydrogen 3.293 N/A ARG 97.A N HIS 93.A O no hydrogen 2.955 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.893 N/A ARG 97.A NH1 ASP 104.A OD1 no hydrogen 2.861 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.908 N/A ASP 98.A N SER 94.A O no hydrogen 2.849 N/A ILE 99.A N GLU 95.A O no hydrogen 2.881 N/A GLU 102.A N ARG 96.A O no hydrogen 3.017 N/A PHE 106.A N ASP 103.A OD1 no hydrogen 2.939 N/A LEU 107.A N ASP 103.A O no hydrogen 2.998 N/A ALA 108.A N ASP 104.A O no hydrogen 2.839 N/A ALA 109.A N GLU 105.A O no hydrogen 3.128 N/A LYS 110.A N PHE 106.A O no hydrogen 3.047 N/A LYS 110.A NZ ASN 63.A OD1 no hydrogen 2.812 N/A LYS 110.A NZ VAL 64.A O no hydrogen 3.117 N/A LYS 110.A NZ GLU 102.A OE1 no hydrogen 3.169 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 3.015 N/A ALA 111.A N LEU 107.A O no hydrogen 2.918 N/A LYS 112.A N ALA 108.A O no hydrogen 2.989 N/A LYS 112.A NZ GLU 116.A OE2 no hydrogen 2.491 N/A PHE 113.A N ALA 109.A O no hydrogen 3.013 N/A ALA 114.A N LYS 110.A O no hydrogen 2.859 N/A LEU 115.A N ALA 111.A O no hydrogen 2.987 N/A GLU 116.A N LYS 112.A O no hydrogen 2.905 N/A ASN 117.A N PHE 113.A O no hydrogen 3.105 N/A ASN 117.A N ALA 114.A O no hydrogen 3.093 N/A ASN 117.A ND2 PHE 113.A O no hydrogen 2.794 N/A GLY 118.A N LEU 115.A O no hydrogen 3.057 N/A MET 119.A N ALA 114.A O no hydrogen 2.952 N/A LYS 120.A N GLU 87.A O no hydrogen 2.856 N/A ILE 121.A N ASP 159.A O no hydrogen 2.917 N/A ILE 122.A N THR 89.A O no hydrogen 2.912 N/A TYR 123.A N VAL 161.A O no hydrogen 2.796 N/A CYS 124.A N LEU 91.A O no hydrogen 2.927 N/A CYS 124.A SG LEU 91.A O no hydrogen 3.729 N/A CYS 125.A N ALA 163.A O no hydrogen 2.945 N/A CYS 125.A SG ALA 163.A O no hydrogen 3.819 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.854 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.779 N/A SER 130.A OG.B GLU 131.A OE1 no hydrogen 2.906 N/A SER 130.A OG.B GLU 131.A OE2 no hydrogen 2.745 N/A ARG 132.A N HIS 128.A O no hydrogen 3.111 N/A ARG 132.A NE GLU 127.A OE2 no hydrogen 2.828 N/A ARG 132.A NH2 GLU 127.A OE2 no hydrogen 2.756 N/A GLU 133.A N.A LEU 129.A O no hydrogen 2.925 N/A GLU 133.A N.B LEU 129.A O no hydrogen 2.921 N/A ALA 134.A N SER 130.A O.A no hydrogen 2.891 N/A ALA 134.A N SER 130.A O.B no hydrogen 2.934 N/A GLY 135.A N ARG 132.A O no hydrogen 3.054 N/A LYS 136.A N GLU 131.A O no hydrogen 2.854 N/A SER 138.A OG.B GLU 139.A OE1 no hydrogen 3.182 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 2.761 N/A PHE 140.A N LYS 136.A O no hydrogen 3.139 N/A VAL 141.A N ALA 137.A O no hydrogen 2.976 N/A SER 142.A N SER 138.A O.A no hydrogen 2.801 N/A SER 142.A N SER 138.A O.B no hydrogen 2.796 N/A SER 142.A OG GLU 146.A OE1 no hydrogen 2.849 N/A ALA 143.A N GLU 139.A O no hydrogen 3.168 N/A GLN 144.A N PHE 140.A O no hydrogen 3.212 N/A ILE 145.A N VAL 141.A O no hydrogen 2.941 N/A GLU 146.A N SER 142.A O no hydrogen 2.717 N/A LYS 147.A N ALA 143.A O no hydrogen 3.100 N/A MET 148.A N GLN 144.A O no hydrogen 3.133 N/A ILE 149.A N ILE 145.A O no hydrogen 2.877 N/A ALA 151.A N MET 148.A O no hydrogen 2.871 N/A ILE 152.A N ILE 149.A O no hydrogen 3.064 N/A LYS 156.A N PRO 153.A O no hydrogen 3.034 N/A LYS 156.A NZ LEU 115.A O no hydrogen 3.039 N/A ASP 159.A N LYS 156.A O no hydrogen 2.926 N/A VAL 160.A N TRP 157.A O no hydrogen 3.263 N/A VAL 161.A N ILE 121.A O no hydrogen 2.914 N/A ILE 162.A N ARG 205.A O no hydrogen 3.022 N/A ALA 163.A N TYR 123.A O no hydrogen 2.886 N/A TYR 164.A N LEU 207.A O no hydrogen 2.835 N/A TYR 164.A OH GLU 127.A OE1 no hydrogen 2.570 N/A TYR 164.A OH GLU 127.A OE2 no hydrogen 3.259 N/A GLU 165.A N CYS 125.A O no hydrogen 2.752 N/A TRP 168.A N GLU 127.A O no hydrogen 3.127 N/A TRP 168.A NE1 TYR 164.A OH no hydrogen 3.011 N/A ALA 169.A N PRO 166.A O no hydrogen 2.763 N/A ILE 170.A N ILE 167.A O no hydrogen 3.013 N/A THR 172.A OG1 TRP 168.A O no hydrogen 2.654 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.152 N/A SER 177.A N ASP 180.A OD2 no hydrogen 2.955 N/A ASP 180.A N SER 177.A OG no hydrogen 2.925 N/A ALA 181.A N SER 177.A O no hydrogen 3.215 N/A GLN 182.A N THR 178.A O no hydrogen 3.021 N/A GLN 182.A NE2 ASP 225.A OD2 no hydrogen 2.781 N/A GLU 183.A N GLN 179.A O no hydrogen 2.920 N/A MET 184.A N ASP 180.A O no hydrogen 3.114 N/A CYS 185.A N ALA 181.A O no hydrogen 3.098 N/A CYS 185.A SG ALA 181.A O no hydrogen 3.465 N/A LYS 186.A N GLN 182.A O no hydrogen 2.991 N/A LYS 186.A NZ ASP 190.A OD1 no hydrogen 2.878 N/A VAL 187.A N GLU 183.A O no hydrogen 2.893 N/A ILE 188.A N MET 184.A O no hydrogen 3.065 N/A ARG 189.A N CYS 185.A O no hydrogen 2.963 N/A ARG 189.A NE ASP 225.A OD1 no hydrogen 2.874 N/A ARG 189.A NH1 ALA 201.A O no hydrogen 2.907 N/A ARG 189.A NH1 VAL 204.A O no hydrogen 2.944 N/A ARG 189.A NH2 ASP 225.A O no hydrogen 2.984 N/A ARG 189.A NH2 ASP 227.A OD2 no hydrogen 2.622 N/A ASP 190.A N LYS 186.A O no hydrogen 2.896 N/A ILE 191.A N VAL 187.A O no hydrogen 3.022 N/A LEU 192.A N ILE 188.A O no hydrogen 2.988 N/A ALA 193.A N ARG 189.A O no hydrogen 2.928 N/A ALA 194.A N ASP 190.A O no hydrogen 2.950 N/A LYS 195.A N ILE 191.A O no hydrogen 2.934 N/A VAL 196.A N LEU 192.A O no hydrogen 2.760 N/A GLY 197.A N LEU 192.A O no hydrogen 3.123 N/A GLY 197.A N ALA 193.A O no hydrogen 3.098 N/A ALA 201.A N GLY 197.A O no hydrogen 3.069 N/A ASN 202.A N ALA 198.A O no hydrogen 2.783 N/A LYS 203.A N ILE 200.A O no hydrogen 3.020 N/A LYS 203.A NZ ASP 158.A OD1 no hydrogen 2.888 N/A VAL 204.A N ILE 200.A O no hydrogen 3.055 N/A ARG 205.A NH1 THR 2.A O no hydrogen 2.952 N/A ARG 205.A NH1 GLU 36.A OE1 no hydrogen 2.831 N/A ARG 205.A NH2 GLU 36.A OE1 no hydrogen 2.858 N/A ILE 206.A N ASP 227.A OD2 no hydrogen 2.901 N/A LEU 207.A N ILE 162.A O no hydrogen 2.685 N/A TYR 208.A N GLY 228.A O no hydrogen 2.905 N/A GLY 209.A N TYR 164.A O no hydrogen 2.692 N/A LYS 213.A N ASN 216.A OD1 no hydrogen 2.846 N/A ASN 216.A N LYS 213.A O no hydrogen 3.195 N/A ASN 216.A ND2 SER 211.A O no hydrogen 3.081 N/A CYS 217.A N LYS 213.A O no hydrogen 3.072 N/A CYS 217.A SG LYS 213.A O no hydrogen 3.579 N/A CYS 217.A SG PRO 214.A O no hydrogen 3.623 N/A CYS 217.A SG ASN 218.A OD1 no hydrogen 3.764 N/A CYS 217.A SG ASN 242.A O no hydrogen 3.794 N/A LEU 220.A N ASN 216.A O no hydrogen 3.152 N/A ALA 221.A N CYS 217.A O no hydrogen 2.858 N/A ALA 222.A N ASN 218.A O no hydrogen 3.180 N/A CYS 223.A N LEU 220.A O no hydrogen 3.043 N/A CYS 223.A SG THR 178.A O no hydrogen 3.933 N/A CYS 223.A SG GLU 219.A O no hydrogen 3.709 N/A ASP 225.A N GLN 182.A OE1 no hydrogen 2.903 N/A VAL 226.A N CYS 223.A O no hydrogen 3.360 N/A ASP 227.A N ILE 206.A O no hydrogen 2.867 N/A PHE 229.A N PHE 4.A O no hydrogen 2.967 N/A LEU 230.A N TYR 208.A O no hydrogen 3.098 N/A VAL 231.A N GLY 6.A O no hydrogen 2.809 N/A SER 235.A N GLY 232.A O no hydrogen 2.884 N/A SER 235.A OG GLY 232.A O no hydrogen 2.770 N/A LEU 236.A N GLY 233.A O no hydrogen 3.106 N/A GLU 237.A N ALA 234.A O no hydrogen 3.124 N/A PHE 240.A N GLU 237.A O no hydrogen 3.027 N/A ILE 241.A N ALA 238.A O no hydrogen 3.391 N/A ILE 243.A N GLY 239.A O no hydrogen 3.271 N/A VAL 244.A N PHE 240.A O no hydrogen 2.934 N/A ASN 245.A N ILE 241.A O no hydrogen 2.871 N/A ASN 245.A ND2 LYS 30.A O no hydrogen 3.125 N/A SER 246.A N ILE 243.A O no hydrogen 3.092 N/A SER 246.A OG ILE 243.A O no hydrogen 2.699 N/A ASN 247.A ND2 GLU 32.A O no hydrogen 2.817 N/A ASN 247.A ND2 VAL 244.A O no hydrogen 2.960 N/A VAL 248.A N ASN 245.A O no hydrogen 3.411 N/A HIS 249.A N SER 246.A O no hydrogen 2.963 N/A SER 250.A N ASN 247.A O no hydrogen 3.031 N/A SER 250.A OG ALA 221.A O no hydrogen 3.199 N/A