Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hqk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N GLY 30.A O no hydrogen 3.029 N/A LYS 8.A N ASP 108.A O no hydrogen 3.138 N/A ILE 9.A N GLY 28.A O no hydrogen 2.859 N/A LYS 10.A N PHE 110.A O no hydrogen 2.972 N/A LEU 11.A N GLY 26.A O no hydrogen 2.927 N/A LYS 12.A N TYR 112.A O no hydrogen 3.110 N/A LYS 12.A NZ.A GLU 14.A OE1.B no hydrogen 2.142 N/A LYS 12.A NZ.A GLU 14.A OE2.A no hydrogen 2.627 N/A LYS 12.A NZ.A GLU 113.A OE1 no hydrogen 3.058 N/A LYS 12.A NZ.A GLU 113.A OE2 no hydrogen 2.851 N/A MET 13.A N ILE 24.A O no hydrogen 2.807 N/A GLU 14.A N ILE 114.A O no hydrogen 2.921 N/A GLY 15.A N PHE 22.A O no hydrogen 3.019 N/A ASN 16.A N LEU 116.A O no hydrogen 2.972 N/A VAL 17.A N HIS 20.A O no hydrogen 3.037 N/A ASN 18.A N GLY 118.A O no hydrogen 2.912 N/A ASN 18.A ND2 PHE 121.A O no hydrogen 2.939 N/A HIS 20.A N VAL 17.A O no hydrogen 2.901 N/A HIS 20.A NE2 GLY 46.A O no hydrogen 2.786 N/A PHE 22.A N GLY 15.A O no hydrogen 2.947 N/A VAL 23.A N GLU 45.A O no hydrogen 2.991 N/A ILE 24.A N MET 13.A O no hydrogen 2.907 N/A GLU 25.A N GLU 42.A O no hydrogen 2.972 N/A GLY 26.A N LEU 11.A O no hydrogen 2.900 N/A GLU 27.A N ASN 40.A O no hydrogen 2.957 N/A GLY 28.A N ILE 9.A O no hydrogen 2.882 N/A GLU 29.A N THR 38.A O no hydrogen 2.973 N/A GLY 30.A N MET 7.A O no hydrogen 2.926 N/A LYS 31.A N THR 36.A O no hydrogen 2.861 N/A LYS 31.A NZ.A ASP 6.A OD1 no hydrogen 2.976 N/A TYR 33.A OH ILE 3.A O no hydrogen 2.801 N/A ASP 34.A N LYS 31.A O no hydrogen 3.002 N/A GLY 35.A N LYS 31.A O no hydrogen 3.017 N/A THR 36.A N LYS 31.A O no hydrogen 3.454 N/A ASN 37.A N GLU 207.A O no hydrogen 3.074 N/A ASN 37.A ND2 GLU 207.A OE1 no hydrogen 2.818 N/A THR 38.A N GLU 29.A O no hydrogen 2.930 N/A ILE 39.A N VAL 205.A O no hydrogen 2.906 N/A ASN 40.A N GLU 27.A O no hydrogen 2.865 N/A ASN 40.A ND2 GLU 27.A O no hydrogen 3.609 N/A ASN 40.A ND2 GLU 27.A OE2 no hydrogen 2.973 N/A LEU 41.A N VAL 203.A O no hydrogen 2.716 N/A GLU 42.A N GLU 25.A O no hydrogen 2.867 N/A VAL 43.A N ASN 201.A O no hydrogen 2.831 N/A LYS 44.A N VAL 23.A O no hydrogen 2.778 N/A LYS 44.A NZ GLU 42.A OE1 no hydrogen 2.728 N/A GLU 45.A N VAL 23.A O no hydrogen 3.234 N/A SER 52.A N VAL 127.A O no hydrogen 2.815 N/A SER 52.A OG THR 132.A OG1 no hydrogen 2.614 N/A ASP 54.A N SER 52.A OG no hydrogen 3.068 N/A ILE 55.A N SER 52.A O no hydrogen 3.238 N/A LEU 56.A N TYR 53.A O no hydrogen 2.909 N/A THR 57.A OG1 ASP 54.A O no hydrogen 3.323 N/A ALA 59.A N LEU 56.A O no hydrogen 3.001 N/A PHE 60.A N LEU 56.A O no hydrogen 3.262 N/A ASN 61.A ND2 TYR 112.A OH no hydrogen 2.986 N/A ARG 62.A NE THR 65.A OG1 no hydrogen 2.766 N/A ARG 62.A NH1 GLU 207.A OE2 no hydrogen 3.150 N/A ARG 62.A NH2 PHE 64.A O no hydrogen 2.952 N/A ARG 62.A NH2 GLU 207.A OE2 no hydrogen 2.745 N/A ALA 63.A N ASN 61.A OD1 no hydrogen 2.951 N/A PHE 64.A N ASN 61.A O no hydrogen 2.931 N/A THR 65.A OG1 ARG 62.A O no hydrogen 2.654 N/A LYS 66.A N ALA 209.A O no hydrogen 2.913 N/A TYR 67.A OH HIS 185.A NE2 no hydrogen 2.737 N/A ILE 71.A N PRO 68.A O no hydrogen 3.164 N/A TYR 74.A OH TYR 173.A O no hydrogen 3.261 N/A LYS 76.A N ASN 73.A OD1 no hydrogen 2.978 N/A LYS 76.A NZ PRO 32.A O no hydrogen 2.908 N/A LYS 76.A NZ ALA 63.A O no hydrogen 2.958 N/A GLN 77.A N ASN 73.A O no hydrogen 3.103 N/A GLN 77.A NE2 ASN 73.A O no hydrogen 3.167 N/A GLN 77.A NE2 LYS 180.A O no hydrogen 2.825 N/A SER 78.A N PHE 75.A O no hydrogen 3.122 N/A SER 78.A OG PHE 75.A O no hydrogen 2.783 N/A PHE 79.A N LYS 76.A O no hydrogen 3.310 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.746 N/A GLY 82.A N SER 78.A O no hydrogen 2.769 N/A TYR 83.A N ILE 103.A O no hydrogen 3.227 N/A TYR 83.A OH ASN 61.A OD1 no hydrogen 2.720 N/A SER 84.A N ARG 174.A O no hydrogen 3.014 N/A TRP 85.A N SER 101.A O no hydrogen 2.886 N/A GLU 86.A N ILE 172.A O no hydrogen 2.986 N/A ARG 87.A N VAL 99.A O no hydrogen 2.924 N/A ARG 87.A NE THR 171.A OG1 no hydrogen 2.805 N/A ARG 87.A NH1 THR 58.A O no hydrogen 2.875 N/A ARG 87.A NH2 TYR 173.A OH no hydrogen 3.525 N/A THR 88.A N LYS 170.A O no hydrogen 2.885 N/A MET 89.A N VAL 97.A O no hydrogen 2.787 N/A THR 90.A N ASP 168.A O no hydrogen 2.868 N/A PHE 91.A N GLY 95.A O no hydrogen 2.984 N/A ILE 96.A N GLU 119.A O no hydrogen 2.951 N/A VAL 97.A N MET 89.A O no hydrogen 2.988 N/A LYS 98.A N LYS 117.A O no hydrogen 2.915 N/A VAL 99.A N ARG 87.A O no hydrogen 2.903 N/A LYS 100.A N HIS 115.A O no hydrogen 2.894 N/A SER 101.A N TRP 85.A O no hydrogen 2.889 N/A SER 101.A OG GLU 113.A O no hydrogen 3.556 N/A ASP 102.A N GLU 113.A O no hydrogen 2.988 N/A ILE 103.A N TYR 83.A O no hydrogen 2.953 N/A SER 104.A N ILE 111.A O no hydrogen 2.952 N/A SER 104.A OG ILE 111.A O no hydrogen 3.370 N/A GLU 106.A N SER 109.A O no hydrogen 2.870 N/A SER 109.A N GLU 106.A O no hydrogen 3.114 N/A SER 109.A OG GLU 106.A O no hydrogen 2.708 N/A PHE 110.A N LYS 8.A O no hydrogen 2.889 N/A ILE 111.A N SER 104.A O no hydrogen 2.856 N/A TYR 112.A N LYS 10.A O no hydrogen 2.887 N/A GLU 113.A N ASP 102.A O no hydrogen 3.054 N/A ILE 114.A N LYS 12.A O no hydrogen 2.886 N/A HIS 115.A N LYS 100.A O no hydrogen 2.784 N/A LEU 116.A N GLU 14.A O no hydrogen 3.079 N/A LYS 117.A N LYS 98.A O no hydrogen 2.882 N/A LYS 117.A NZ GLU 119.A OE1.A no hydrogen 3.355 N/A LYS 117.A NZ GLU 119.A OE1.B no hydrogen 3.405 N/A GLY 118.A N ASN 16.A O no hydrogen 2.809 N/A GLU 119.A N ILE 96.A O no hydrogen 2.850 N/A PHE 121.A N ASN 18.A OD1 no hydrogen 3.022 N/A GLY 125.A N PRO 122.A O no hydrogen 3.052 N/A GLN 129.A N GLY 125.A O no hydrogen 2.921 N/A LYS 130.A N VAL 127.A O no hydrogen 3.233 N/A LYS 131.A N PRO 126.A O no hydrogen 2.821 N/A THR 132.A OG1 SER 52.A OG no hydrogen 2.614 N/A THR 132.A OG1 ASP 54.A OD2 no hydrogen 2.506 N/A THR 133.A N LEU 158.A O no hydrogen 2.798 N/A TRP 135.A NE1 ASP 54.A O no hydrogen 2.849 N/A ASP 136.A N LYS 156.A O no hydrogen 3.114 N/A SER 138.A N.A HIS 189.A O no hydrogen 3.135 N/A SER 138.A N.B HIS 189.A O no hydrogen 3.390 N/A SER 138.A OG.A HIS 155.A NE2 no hydrogen 3.035 N/A SER 138.A OG.B LYS 154.A O no hydrogen 2.913 N/A THR 139.A OG1 ASP 188.A OD1 no hydrogen 2.683 N/A GLU 140.A N VAL 187.A O no hydrogen 2.831 N/A ARG 141.A N ASP 152.A O no hydrogen 2.853 N/A MET 142.A N HIS 185.A O no hydrogen 2.838 N/A TYR 143.A N LYS 150.A O no hydrogen 2.903 N/A TYR 143.A OH ASP 152.A OD2 no hydrogen 2.688 N/A ARG 145.A N VAL 148.A O no hydrogen 3.038 N/A ARG 145.A NH1 VAL 144.A O no hydrogen 2.776 N/A ARG 145.A NH1 TYR 184.A OH no hydrogen 3.036 N/A ARG 145.A NH2 TYR 184.A OH no hydrogen 3.287 N/A VAL 148.A N ARG 145.A O no hydrogen 3.035 N/A LEU 149.A N TYR 173.A O no hydrogen 3.167 N/A LYS 150.A N TYR 143.A O no hydrogen 2.777 N/A LYS 150.A NZ ASP 146.A OD2 no hydrogen 3.530 N/A GLY 151.A N THR 171.A O no hydrogen 2.893 N/A ASP 152.A N ARG 141.A O no hydrogen 2.991 N/A VAL 153.A N PHE 169.A O no hydrogen 3.016 N/A HIS 155.A N VAL 167.A O no hydrogen 2.831 N/A HIS 155.A ND1 ASP 136.A OD1 no hydrogen 2.791 N/A LYS 156.A N ASP 136.A OD1 no hydrogen 2.767 N/A LEU 157.A N HIS 165.A O no hydrogen 2.812 N/A LEU 158.A N GLY 134.A O no hydrogen 2.850 N/A LEU 159.A N GLY 163.A O no hydrogen 2.888 N/A GLU 160.A N LYS 131.A O no hydrogen 2.817 N/A GLY 162.A N LEU 159.A O no hydrogen 2.909 N/A HIS 165.A N LEU 157.A O no hydrogen 2.899 N/A ARG 166.A N GLU 92.A OE2.A no hydrogen 2.763 N/A ARG 166.A NE ASP 168.A OD1 no hydrogen 2.962 N/A ARG 166.A NE ASP 168.A OD2 no hydrogen 3.321 N/A ARG 166.A NH2 ASP 168.A OD2 no hydrogen 3.022 N/A VAL 167.A N HIS 155.A O no hydrogen 2.883 N/A ASP 168.A N THR 90.A O no hydrogen 2.923 N/A PHE 169.A N VAL 153.A O no hydrogen 2.780 N/A LYS 170.A N THR 88.A O no hydrogen 2.966 N/A LYS 170.A NZ.B ASP 152.A OD1 no hydrogen 2.936 N/A THR 171.A N GLY 151.A O no hydrogen 2.828 N/A ILE 172.A N GLU 86.A O no hydrogen 2.812 N/A TYR 173.A N LEU 149.A O no hydrogen 2.767 N/A TYR 173.A OH GLU 140.A OE2 no hydrogen 2.694 N/A ARG 174.A N SER 84.A O no hydrogen 2.856 N/A ARG 174.A NH1 GLU 86.A OE2.A no hydrogen 2.612 N/A ALA 175.A N TYR 74.A OH no hydrogen 2.910 N/A LYS 176.A N GLY 82.A O no hydrogen 2.910 N/A LYS 176.A NZ ASP 102.A OD1 no hydrogen 2.684 N/A LYS 176.A NZ ASP 102.A OD2 no hydrogen 3.551 N/A LYS 177.A NZ GLU 81.A OE1 no hydrogen 2.551 N/A LYS 180.A N GLN 77.A OE1 no hydrogen 2.865 N/A TYR 184.A N ASP 183.A OD1 no hydrogen 2.961 N/A HIS 185.A N MET 142.A O no hydrogen 3.097 N/A HIS 185.A ND1 ASP 183.A O no hydrogen 2.907 N/A HIS 185.A NE2 TYR 67.A OH no hydrogen 2.737 N/A PHE 186.A N ARG 212.A O no hydrogen 2.942 N/A VAL 187.A N GLU 140.A O no hydrogen 2.872 N/A ASP 188.A N VAL 210.A O no hydrogen 2.824 N/A HIS 189.A N SER 138.A O.A no hydrogen 2.782 N/A HIS 189.A N SER 138.A O.B no hydrogen 2.880 N/A HIS 189.A NE2 GLU 140.A OE1 no hydrogen 2.673 N/A ARG 190.A N SER 208.A O no hydrogen 3.019 N/A GLU 192.A N TYR 206.A O no hydrogen 2.872 N/A LEU 194.A N THR 204.A O no hydrogen 2.814 N/A HIS 196.A ND1 ASP 197.A O no hydrogen 2.735 N/A ASP 197.A N LYS 202.A O no hydrogen 3.075 N/A TYR 200.A N ASP 197.A O no hydrogen 3.125 N/A LYS 202.A N ASP 197.A OD1 no hydrogen 3.004 N/A LYS 202.A NZ ASN 201.A O no hydrogen 3.276 N/A VAL 203.A N LEU 41.A O no hydrogen 3.031 N/A THR 204.A N ASN 195.A O no hydrogen 2.884 N/A THR 204.A OG1 ASN 40.A OD1 no hydrogen 2.755 N/A THR 204.A OG1 ASN 195.A OD1 no hydrogen 3.097 N/A VAL 205.A N ILE 39.A O no hydrogen 2.858 N/A TYR 206.A N GLU 192.A O no hydrogen 2.859 N/A GLU 207.A N ASN 37.A O no hydrogen 2.957 N/A SER 208.A N ARG 190.A O no hydrogen 2.899 N/A ALA 209.A N GLY 35.A O no hydrogen 2.861 N/A VAL 210.A N ASP 188.A O no hydrogen 2.997 N/A ALA 211.A N LYS 66.A O no hydrogen 2.734 N/A ARG 212.A N PHE 186.A O no hydrogen 2.865 N/A ARG 212.A NE ASP 188.A OD2 no hydrogen 2.849 N/A ARG 212.A NH2 ASP 188.A OD1 no hydrogen 2.898 N/A