Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qdf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 168.A OD2 no hydrogen 2.649 N/A MET 2.A N THR 167.A OG1 no hydrogen 2.844 N/A ARG 3.A NH1 ILE 18.A O no hydrogen 3.057 N/A ARG 3.A NH1 GLY 20.A O no hydrogen 2.832 N/A ARG 3.A NH2 GLY 20.A O no hydrogen 2.886 N/A LEU 4.A N ILE 165.A O no hydrogen 2.725 N/A GLY 5.A N ALA 16.A O no hydrogen 2.954 N/A ARG 6.A NH1 ALA 57.A O no hydrogen 2.839 N/A ILE 7.A N ALA 14.A O no hydrogen 2.804 N/A ALA 8.A N ARG 54.A O no hydrogen 2.845 N/A SER 9.A N GLY 12.A O no hydrogen 2.719 N/A SER 9.A OG ASP 11.A OD1.B no hydrogen 2.763 N/A SER 9.A OG GLY 12.A O no hydrogen 3.174 N/A GLY 12.A N SER 9.A O no hydrogen 3.281 N/A ALA 14.A N ILE 7.A O no hydrogen 2.919 N/A ALA 16.A N GLY 5.A O no hydrogen 2.808 N/A SER 17.A N ARG 31.A O no hydrogen 2.821 N/A ILE 18.A N ARG 3.A O no hydrogen 2.860 N/A GLU 19.A N THR 29.A O no hydrogen 2.776 N/A ASN 24.A N GLU 21.A O no hydrogen 3.080 N/A ALA 27.A N ASN 24.A OD1 no hydrogen 3.467 N/A MET 28.A N PRO 25.A O no hydrogen 3.183 N/A THR 29.A N GLU 19.A O no hydrogen 2.887 N/A ALA 30.A N TRP 48.A O no hydrogen 2.737 N/A ARG 31.A N SER 17.A O no hydrogen 2.777 N/A ARG 31.A NE.A GLU 19.A OE1 no hydrogen 2.911 N/A ARG 31.A NE.A GLU 19.A OE2 no hydrogen 3.024 N/A ARG 31.A NE.B GLU 19.A OE2 no hydrogen 2.597 N/A ARG 31.A NH1.B GLU 19.A OE2 no hydrogen 3.017 N/A ARG 31.A NH2.A GLU 19.A OE1 no hydrogen 3.025 N/A GLU 32.A N ARG 46.A O no hydrogen 2.957 N/A ILE 33.A N PHE 15.A O no hydrogen 2.916 N/A ALA 34.A N ASN 42.A O no hydrogen 2.861 N/A GLU 35.A N ASN 42.A OD1 no hydrogen 2.856 N/A GLY 39.A N HIS 36.A O no hydrogen 3.087 N/A ASN 42.A N GLU 35.A O no hydrogen 3.144 N/A THR 44.A N GLU 32.A O no hydrogen 3.102 N/A THR 44.A OG1 GLU 32.A OE1 no hydrogen 2.644 N/A ARG 46.A N THR 44.A OG1 no hydrogen 3.025 N/A ARG 46.A NH1 GLU 32.A OE1 no hydrogen 2.806 N/A TRP 48.A N ALA 30.A O no hydrogen 3.133 N/A LEU 50.A N MET 28.A O no hydrogen 2.682 N/A ASP 52.A N PRO 49.A O no hydrogen 2.975 N/A VAL 53.A N LEU 50.A O no hydrogen 3.035 N/A ARG 54.A N ALA 8.A O no hydrogen 2.910 N/A ARG 54.A NH2.B LEU 55.A O no hydrogen 3.313 N/A ARG 54.A NH2.B PRO 89.A O no hydrogen 3.205 N/A LEU 56.A N ARG 6.A O no hydrogen 2.818 N/A SER 62.A OG ASP 214.A OD1 no hydrogen 2.561 N/A LYS 63.A N ASP 214.A OD1 no hydrogen 3.312 N/A LYS 63.A NZ THR 209.A O no hydrogen 2.770 N/A LYS 63.A NZ ASP 214.A OD2 no hydrogen 2.816 N/A VAL 64.A N LYS 81.A O no hydrogen 3.397 N/A VAL 65.A N LEU 215.A O no hydrogen 2.816 N/A CYS 66.A N PHE 79.A O no hydrogen 2.870 N/A CYS 66.A SG VAL 64.A O no hydrogen 3.991 N/A VAL 67.A N LEU 217.A O no hydrogen 2.808 N/A GLY 68.A N VAL 77.A O no hydrogen 2.792 N/A ASN 70.A ND2 HIS 195.A O no hydrogen 2.990 N/A ASN 70.A ND2 THR 218.A O no hydrogen 2.908 N/A THR 72.A N LEU 192.A O no hydrogen 2.905 N/A PHE 79.A N CYS 66.A O no hydrogen 2.980 N/A LYS 81.A N VAL 64.A O no hydrogen 2.993 N/A LYS 81.A NZ ASP 136.A OD1 no hydrogen 2.663 N/A LYS 81.A NZ LYS 153.A O no hydrogen 2.730 N/A LYS 81.A NZ PHE 158.A O no hydrogen 2.833 N/A ASN 83.A ND2 ALA 61.A O no hydrogen 2.907 N/A ALA 85.A N PRO 82.A O no hydrogen 2.888 N/A ILE 86.A N ASN 83.A O no hydrogen 3.185 N/A VAL 87.A N CYS 159.A O no hydrogen 3.207 N/A ASN 90.A N THR 244.A O no hydrogen 2.742 N/A VAL 91.A N GLY 88.A O no hydrogen 3.414 N/A ILE 93.A N PRO 246.A O no hydrogen 2.883 N/A ARG 94.A N THR 157.A OG1 no hydrogen 2.864 N/A LEU 95.A N VAL 248.A O no hydrogen 2.854 N/A ALA 99.A N PRO 96.A O no hydrogen 3.136 N/A SER 100.A N ASP 141.A OD2 no hydrogen 3.251 N/A HIS 103.A N SER 138.A O no hydrogen 2.778 N/A PHE 104.A N GLY 225.A O no hydrogen 3.194 N/A GLU 105.A N ASN 135.A OD1 no hydrogen 2.949 N/A GLY 106.A N GLN 186.A OE1 no hydrogen 2.938 N/A GLU 107.A N GLY 134.A O no hydrogen 2.877 N/A ALA 109.A N THR 132.A O no hydrogen 2.836 N/A ILE 110.A N ILE 216.A O no hydrogen 2.812 N/A VAL 111.A N GLY 130.A O no hydrogen 2.941 N/A ILE 112.A N ASP 214.A O no hydrogen 3.034 N/A GLY 113.A N ASN 127.A O no hydrogen 2.802 N/A ARG 114.A NE ASN 127.A OD1 no hydrogen 3.071 N/A CYS 116.A N LEU 210.A O no hydrogen 2.879 N/A CYS 116.A SG ARG 114.A O no hydrogen 3.685 N/A ASP 118.A N SER 205.A O no hydrogen 2.786 N/A VAL 119.A N SER 205.A OG no hydrogen 2.983 N/A SER 120.A N GLN 123.A OE1 no hydrogen 3.257 N/A ALA 121.A N GLU 202.A OE2 no hydrogen 2.813 N/A GLN 123.A N SER 120.A O no hydrogen 2.993 N/A GLN 123.A N SER 120.A OG no hydrogen 3.151 N/A ALA 124.A N ALA 121.A O no hydrogen 3.150 N/A ASP 126.A N GLN 123.A O no hydrogen 3.009 N/A ASN 127.A N ALA 124.A O no hydrogen 2.796 N/A ASN 127.A ND2 GLN 123.A O no hydrogen 2.994 N/A LEU 129.A N VAL 111.A O no hydrogen 2.809 N/A GLY 130.A N VAL 111.A O no hydrogen 3.412 N/A TYR 131.A N VAL 166.A O no hydrogen 2.887 N/A THR 132.A N ALA 109.A O no hydrogen 2.875 N/A THR 132.A OG1 TRP 164.A O no hydrogen 2.721 N/A ILE 133.A N GLY 162.A O no hydrogen 3.165 N/A GLY 134.A N GLU 107.A O no hydrogen 2.849 N/A ASN 135.A N PRO 160.A O no hydrogen 3.034 N/A ASP 136.A N GLU 105.A O no hydrogen 2.799 N/A VAL 137.A N ASN 135.A O no hydrogen 2.884 N/A VAL 137.A N PHE 158.A O no hydrogen 3.040 N/A SER 138.A N HIS 103.A O no hydrogen 2.937 N/A SER 138.A OG ASP 136.A O no hydrogen 2.703 N/A ALA 139.A N ALA 152.A O no hydrogen 2.962 N/A ARG 140.A N PRO 101.A O no hydrogen 2.991 N/A ARG 140.A NE HIS 103.A ND1 no hydrogen 2.953 N/A ARG 140.A NH1 GLU 105.A OE1 no hydrogen 2.944 N/A ARG 140.A NH1 GLN 143.A OE1 no hydrogen 2.804 N/A ARG 140.A NH2 HIS 103.A ND1 no hydrogen 3.475 N/A ARG 140.A NH2 GLU 105.A OE1 no hydrogen 2.636 N/A GLN 142.A N ASP 141.A OD1 no hydrogen 2.870 N/A GLN 143.A N ALA 139.A O no hydrogen 3.104 N/A LYS 144.A N ARG 140.A O no hydrogen 3.168 N/A SER 145.A N ASP 141.A O no hydrogen 2.892 N/A ASP 146.A N GLN 142.A O no hydrogen 2.853 N/A GLY 147.A N GLN 143.A O no hydrogen 2.969 N/A ARG 151.A NE ASP 146.A OD1 no hydrogen 3.457 N/A ARG 151.A NE ASP 146.A OD2 no hydrogen 2.881 N/A ARG 151.A NH2 ASP 146.A OD1 no hydrogen 2.893 N/A LYS 153.A N TRP 149.A O no hydrogen 3.082 N/A LYS 153.A N THR 150.A O no hydrogen 3.270 N/A LYS 153.A NZ ASP 136.A OD2 no hydrogen 2.826 N/A LYS 153.A NZ SER 138.A OG no hydrogen 2.666 N/A GLY 154.A N ARG 151.A O no hydrogen 3.112 N/A HIS 155.A NE2 GLN 142.A OE1 no hydrogen 2.798 N/A THR 157.A OG1 ASP 156.A O no hydrogen 2.460 N/A PHE 158.A N HIS 155.A O no hydrogen 3.109 N/A CYS 159.A N ALA 85.A O no hydrogen 2.780 N/A VAL 161.A N VAL 87.A O no hydrogen 2.849 N/A GLY 162.A N ILE 133.A O no hydrogen 3.019 N/A TRP 164.A NE1 ILE 240.A O no hydrogen 2.844 N/A ILE 165.A N LEU 4.A O no hydrogen 2.746 N/A VAL 166.A N TYR 131.A O no hydrogen 2.758 N/A THR 167.A N MET 2.A O no hydrogen 2.961 N/A THR 167.A OG1 MET 2.A O no hydrogen 3.447 N/A ALA 172.A N ASP 170.A OD1 no hydrogen 3.018 N/A LEU 174.A N THR 190.A OG1 no hydrogen 2.813 N/A GLU 175.A N GLU 238.A OE1 no hydrogen 2.911 N/A LEU 176.A N ALA 188.A O no hydrogen 2.609 N/A ARG 177.A N THR 236.A O no hydrogen 2.822 N/A ARG 177.A NE GLU 179.A OE2 no hydrogen 3.068 N/A ARG 177.A NH1 GLU 175.A OE2 no hydrogen 3.456 N/A THR 178.A N GLN 186.A O no hydrogen 2.947 N/A THR 178.A OG1 GLN 186.A OE1 no hydrogen 2.728 N/A GLU 179.A N SER 234.A O no hydrogen 2.704 N/A VAL 180.A N ALA 183.A O no hydrogen 2.966 N/A ASN 181.A N THR 232.A O no hydrogen 2.901 N/A ASN 181.A ND2 ASP 231.A OD1 no hydrogen 3.064 N/A ALA 183.A N VAL 180.A O no hydrogen 3.133 N/A LYS 185.A N THR 178.A O no hydrogen 2.768 N/A GLN 186.A N THR 178.A O no hydrogen 3.418 N/A GLN 186.A NE2 THR 220.A OG1 no hydrogen 2.740 N/A GLN 186.A NE2 PRO 221.A O no hydrogen 2.833 N/A GLN 186.A NE2 ALA 222.A O no hydrogen 3.566 N/A ALA 188.A N LEU 176.A O no hydrogen 2.973 N/A ARG 189.A NE ASP 173.A OD1 no hydrogen 2.846 N/A ARG 189.A NH1 ASP 173.A O no hydrogen 2.955 N/A ARG 189.A NH1 GLU 238.A OE1 no hydrogen 2.896 N/A THR 190.A N LEU 174.A O no hydrogen 2.765 N/A THR 190.A OG1 PRO 171.A O no hydrogen 2.706 N/A THR 190.A OG1 LEU 174.A O no hydrogen 3.473 N/A SER 191.A OG ASP 173.A OD1 no hydrogen 2.668 N/A LEU 192.A N ARG 189.A O no hydrogen 2.981 N/A MET 193.A N THR 190.A O no hydrogen 3.067 N/A ILE 194.A N ASN 70.A O no hydrogen 2.807 N/A HIS 195.A N ASN 70.A OD1 no hydrogen 2.754 N/A ALA 199.A N ASP 196.A OD1 no hydrogen 2.966 N/A ILE 200.A N ASP 196.A O no hydrogen 2.949 N/A VAL 201.A N VAL 197.A O no hydrogen 2.930 N/A GLU 202.A N GLY 198.A O no hydrogen 2.828 N/A TRP 203.A N ALA 199.A O no hydrogen 2.878 N/A ILE 204.A N ILE 200.A O no hydrogen 2.895 N/A SER 205.A N VAL 201.A O no hydrogen 2.930 N/A SER 205.A OG VAL 201.A O no hydrogen 2.886 N/A SER 205.A OG GLU 202.A O no hydrogen 3.501 N/A ALA 206.A N GLU 202.A O no hydrogen 3.168 N/A ALA 206.A N TRP 203.A O no hydrogen 3.310 N/A VAL 207.A N ILE 204.A O no hydrogen 2.920 N/A MET 208.A N ILE 204.A O no hydrogen 2.881 N/A LEU 210.A N CYS 116.A O no hydrogen 2.823 N/A LEU 211.A N ASP 214.A OD2 no hydrogen 2.744 N/A GLY 213.A N ILE 112.A O no hydrogen 2.732 N/A ASP 214.A N LEU 211.A O no hydrogen 2.867 N/A LEU 215.A N LYS 63.A O no hydrogen 3.231 N/A ILE 216.A N ILE 110.A O no hydrogen 2.858 N/A LEU 217.A N VAL 65.A O no hydrogen 2.824 N/A THR 218.A N LEU 108.A O no hydrogen 3.128 N/A THR 218.A OG1 LEU 108.A O no hydrogen 2.921 N/A GLY 219.A N GLU 107.A OE1 no hydrogen 2.836 N/A THR 220.A OG1 GLY 106.A O no hydrogen 2.758 N/A ILE 227.A N VAL 102.A O no hydrogen 2.781 N/A GLU 228.A N ASP 231.A OD2 no hydrogen 2.723 N/A GLY 230.A N VAL 247.A O no hydrogen 3.053 N/A ASP 231.A N GLU 228.A O no hydrogen 3.112 N/A THR 232.A N ASN 181.A OD1 no hydrogen 2.959 N/A VAL 233.A N ASN 245.A O no hydrogen 2.953 N/A SER 234.A N GLU 179.A O no hydrogen 2.855 N/A SER 234.A OG THR 244.A OG1 no hydrogen 2.761 N/A ILE 235.A N LEU 243.A O no hydrogen 2.789 N/A THR 236.A N ARG 177.A O no hydrogen 2.707 N/A THR 236.A OG1 THR 242.A OG1 no hydrogen 2.605 N/A ILE 237.A N GLY 241.A O no hydrogen 2.933 N/A GLU 238.A N GLU 175.A O no hydrogen 2.959 N/A ILE 240.A N ILE 237.A O no hydrogen 2.978 N/A GLY 241.A N ILE 237.A O no hydrogen 3.086 N/A THR 242.A OG1 THR 236.A OG1 no hydrogen 2.605 N/A LEU 243.A N ILE 235.A O no hydrogen 2.710 N/A THR 244.A OG1 SER 234.A OG no hydrogen 2.761 N/A ASN 245.A N VAL 233.A O no hydrogen 2.898 N/A ASN 245.A ND2 GLY 88.A O no hydrogen 3.070 N/A ASN 245.A ND2 VAL 91.A O no hydrogen 2.825 N/A VAL 247.A N ASP 231.A O no hydrogen 2.851 N/A VAL 248.A N ILE 93.A O no hydrogen 2.884 N/A ARG 249.A N ASP 229.A OD1 no hydrogen 3.008 N/A ARG 249.A NH1 PRO 96.A O no hydrogen 2.953 N/A ARG 249.A NH1 ALA 99.A O no hydrogen 2.541 N/A ARG 249.A NH2 ALA 99.A O no hydrogen 3.210 N/A ARG 249.A NH2 GLU 228.A OE1 no hydrogen 2.902 N/A LYS 250.A N LEU 95.A O no hydrogen 2.899 N/A