Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xkn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 26.A OG no hydrogen 2.912 N/A GLN 3.A NE2 ASP 1.A O no hydrogen 3.148 N/A THR 5.A N ARG 24.A O no hydrogen 2.825 N/A GLN 6.A NE2.A TYR 86.A O no hydrogen 2.714 N/A GLN 6.A NE2.B TYR 86.A O no hydrogen 3.555 N/A THR 7.A N.B SER 22.A O no hydrogen 3.275 N/A THR 8.A OG1.A SER 10.A O no hydrogen 3.416 N/A THR 8.A OG1.B SER 10.A O no hydrogen 3.292 N/A LEU 11.A N LYS 103.A O no hydrogen 2.845 N/A SER 12.A OG GLU 105.A OE2 no hydrogen 2.655 N/A ALA 13.A N GLU 105.A O no hydrogen 3.051 N/A SER 14.A N ASP 17.A OD2 no hydrogen 2.913 N/A GLY 16.A N LEU 78.A O no hydrogen 2.855 N/A ASP 17.A N SER 14.A O no hydrogen 2.964 N/A VAL 19.A N ILE 75.A O no hydrogen 2.912 N/A ILE 21.A N LEU 73.A O no hydrogen 2.816 N/A SER 22.A OG SER 72.A OG no hydrogen 3.361 N/A CYS 23.A N TYR 71.A O no hydrogen 2.906 N/A ARG 24.A N THR 5.A O no hydrogen 2.889 N/A ARG 24.A NE ASP 70.A OD1 no hydrogen 2.826 N/A ARG 24.A NH2 ASP 70.A OD2 no hydrogen 2.978 N/A ALA 25.A N THR 69.A O no hydrogen 2.776 N/A SER 26.A N GLN 3.A O no hydrogen 2.923 N/A SER 26.A OG GLN 3.A O no hydrogen 3.549 N/A SER 26.A OG GLN 3.A OE1 no hydrogen 3.551 N/A ILE 29.A N GLY 68.A O no hydrogen 3.131 N/A SER 30.A N.A ASP 28.A OD1 no hydrogen 2.899 N/A SER 30.A N.B ASP 28.A OD1 no hydrogen 2.891 N/A SER 30.A OG.B ASN 92.A OD1 no hydrogen 2.757 N/A ASN 31.A N TYR 71.A OH no hydrogen 2.968 N/A ASN 31.A ND2 THR 51.A OG1 no hydrogen 2.944 N/A ASN 31.A ND2 GLY 66.A O no hydrogen 2.994 N/A TYR 32.A N ILE 29.A O no hydrogen 3.040 N/A LEU 33.A N ASN 31.A O no hydrogen 2.943 N/A ASN 34.A N GLN 89.A O no hydrogen 2.817 N/A ASN 34.A ND2 GLN 89.A OE1 no hydrogen 2.889 N/A TRP 35.A N ILE 48.A O no hydrogen 2.822 N/A TYR 36.A N PHE 87.A O no hydrogen 2.817 N/A TYR 36.A OH GLN 89.A OE1 no hydrogen 2.666 N/A GLN 37.A N LYS 45.A O no hydrogen 2.926 N/A GLN 38.A N THR 85.A O no hydrogen 2.773 N/A GLN 38.A NE2 GLY 42.A O no hydrogen 3.040 N/A LYS 39.A N THR 43.A O.A no hydrogen 2.862 N/A LYS 39.A N THR 43.A O.B no hydrogen 2.963 N/A LYS 39.A NZ GLU 81.A O no hydrogen 3.387 N/A GLY 42.A N LYS 39.A O no hydrogen 2.848 N/A THR 43.A N.A ASP 41.A OD2 no hydrogen 2.899 N/A THR 43.A N.B ASP 41.A OD2 no hydrogen 2.914 N/A THR 43.A OG1.A ASP 41.A OD1 no hydrogen 3.545 N/A THR 43.A OG1.A ASP 41.A OD2 no hydrogen 2.763 N/A THR 43.A OG1.B ASP 41.A OD2 no hydrogen 2.959 N/A LYS 45.A N GLN 37.A O no hydrogen 2.928 N/A LEU 47.A N TRP 35.A O no hydrogen 2.846 N/A ILE 48.A N TRP 35.A O no hydrogen 3.325 N/A TYR 49.A N ARG 53.A O.A no hydrogen 2.814 N/A TYR 49.A N ARG 53.A O.B no hydrogen 2.845 N/A TYR 50.A N.A ASN 34.A OD1 no hydrogen 3.042 N/A TYR 50.A N.B ASN 34.A OD1 no hydrogen 3.047 N/A THR 51.A N LEU 33.A O no hydrogen 2.779 N/A THR 51.A OG1 ASN 31.A O no hydrogen 2.752 N/A SER 52.A N TYR 50.A O.A no hydrogen 2.854 N/A ARG 53.A N.A TYR 49.A O no hydrogen 2.944 N/A ARG 53.A N.B TYR 49.A O no hydrogen 2.920 N/A ARG 53.A NH1.A SER 52.A OG no hydrogen 2.871 N/A HIS 55.A N LEU 47.A O no hydrogen 2.907 N/A VAL 58.A N HIS 55.A O no hydrogen 3.183 N/A ARG 61.A N THR 59.A OG1 no hydrogen 3.180 N/A ARG 61.A NH1 ASN 77.A O no hydrogen 2.957 N/A ARG 61.A NH1 ASP 82.A OD1 no hydrogen 3.560 N/A ARG 61.A NH1 ASP 82.A OD2 no hydrogen 2.754 N/A ARG 61.A NH2 ASP 82.A OD1 no hydrogen 2.833 N/A ARG 61.A NH2 ASP 82.A OD2 no hydrogen 3.523 N/A PHE 62.A N.A THR 59.A O no hydrogen 3.276 N/A PHE 62.A N.B THR 59.A O no hydrogen 3.264 N/A SER 63.A N THR 74.A O no hydrogen 2.954 N/A SER 65.A N SER 72.A O no hydrogen 2.969 N/A SER 67.A N ASP 70.A O no hydrogen 3.057 N/A THR 69.A OG1 ASP 70.A OD1 no hydrogen 2.910 N/A ASP 70.A N SER 67.A O no hydrogen 3.091 N/A TYR 71.A N CYS 23.A O no hydrogen 2.946 N/A TYR 71.A OH GLY 68.A O no hydrogen 2.781 N/A SER 72.A N SER 65.A O no hydrogen 2.894 N/A SER 72.A OG SER 22.A OG no hydrogen 3.361 N/A LEU 73.A N ILE 21.A O no hydrogen 2.841 N/A THR 74.A N SER 63.A O no hydrogen 2.816 N/A ILE 75.A N VAL 19.A O no hydrogen 2.750 N/A SER 76.A N ARG 61.A O no hydrogen 2.889 N/A SER 76.A OG ARG 61.A O no hydrogen 3.563 N/A SER 76.A OG ASN 77.A OD1 no hydrogen 2.609 N/A LEU 78.A N ASP 17.A O no hydrogen 2.816 N/A GLU 79.A N.A ASP 82.A OD2 no hydrogen 2.862 N/A GLU 79.A N.B ASP 82.A OD2 no hydrogen 2.860 N/A GLN 80.A NE2 SER 168.A O no hydrogen 2.925 N/A GLN 80.A NE2 SER 171.A OG no hydrogen 2.951 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.836 N/A ASP 82.A N GLU 79.A O.A no hydrogen 2.983 N/A ASP 82.A N GLU 79.A O.B no hydrogen 2.906 N/A THR 85.A N GLN 38.A O no hydrogen 2.889 N/A TYR 86.A N THR 102.A O no hydrogen 2.856 N/A TYR 86.A OH GLN 37.A OE1 no hydrogen 3.000 N/A TYR 86.A OH ASP 82.A O no hydrogen 2.711 N/A PHE 87.A N TYR 36.A O no hydrogen 2.899 N/A CYS 88.A N GLN 6.A OE1.A no hydrogen 3.453 N/A GLN 89.A N ASN 34.A O no hydrogen 2.866 N/A GLN 89.A NE2 GLN 90.A O no hydrogen 2.879 N/A GLN 90.A N THR 97.A O no hydrogen 2.957 N/A GLN 90.A NE2 THR 93.A O no hydrogen 2.951 N/A GLN 90.A NE2 THR 97.A OG1 no hydrogen 3.016 N/A GLY 91.A N TYR 32.A O no hydrogen 2.836 N/A ASN 92.A N GLN 90.A OE1 no hydrogen 2.799 N/A THR 93.A N GLN 90.A OE1 no hydrogen 3.087 N/A THR 97.A OG1 ILE 2.A O no hydrogen 2.717 N/A GLY 99.A N CYS 88.A O no hydrogen 2.793 N/A GLY 101.A N GLN 6.A OE1.A no hydrogen 2.663 N/A THR 102.A N TYR 86.A O no hydrogen 2.870 N/A THR 102.A OG1 GLN 6.A OE1.B no hydrogen 2.970 N/A THR 102.A OG1 THR 8.A O.A no hydrogen 2.655 N/A THR 102.A OG1 THR 8.A O.B no hydrogen 2.632 N/A LYS 103.A N SER 9.A O no hydrogen 2.862 N/A VAL 104.A N ALA 84.A O no hydrogen 2.888 N/A GLU 105.A N LEU 11.A O no hydrogen 2.858 N/A ILE 106.A N GLN 166.A OE1 no hydrogen 2.971 N/A LYS 107.A N ALA 13.A O no hydrogen 2.792 N/A LYS 107.A NZ SER 12.A OG no hydrogen 2.749 N/A ARG 108.A NE ALA 109.A O no hydrogen 2.719 N/A ARG 108.A NH1 ASP 170.A O no hydrogen 2.921 N/A ARG 108.A NH2 ALA 109.A O no hydrogen 3.188 N/A ALA 111.A N TYR 140.A O no hydrogen 2.836 N/A THR 114.A N ASN 137.A O no hydrogen 2.926 N/A SER 116.A N PHE 135.A O no hydrogen 2.928 N/A PHE 118.A N VAL 133.A O no hydrogen 2.823 N/A SER 122.A OG.A GLU 123.A OE2.B no hydrogen 3.427 N/A GLU 123.A N.B GLU 123.A OE2.B no hydrogen 2.918 N/A GLN 124.A N SER 121.A OG no hydrogen 3.171 N/A GLN 124.A NE2 SER 131.A OG no hydrogen 2.950 N/A LEU 125.A N SER 121.A O no hydrogen 3.091 N/A THR 126.A N SER 122.A O.A no hydrogen 3.096 N/A THR 126.A N SER 122.A O.B no hydrogen 2.929 N/A THR 126.A OG1 SER 122.A O.A no hydrogen 2.914 N/A THR 126.A OG1 SER 122.A O.B no hydrogen 3.089 N/A SER 127.A N GLU 123.A O.A no hydrogen 3.259 N/A SER 127.A N GLU 123.A O.B no hydrogen 3.294 N/A SER 127.A OG GLN 124.A O no hydrogen 2.688 N/A GLY 128.A N LEU 125.A O no hydrogen 2.873 N/A GLY 129.A N GLN 124.A O no hydrogen 3.155 N/A ALA 130.A N LEU 181.A O no hydrogen 2.892 N/A SER 131.A N GLN 124.A OE1 no hydrogen 2.868 N/A SER 131.A OG THR 180.A OG1 no hydrogen 2.754 N/A VAL 132.A N LEU 179.A O no hydrogen 2.779 N/A VAL 133.A N PHE 118.A O no hydrogen 3.139 N/A CYS 134.A N SER 177.A O no hydrogen 2.793 N/A CYS 134.A SG SER 116.A O no hydrogen 3.731 N/A PHE 135.A N SER 116.A O no hydrogen 2.890 N/A LEU 136.A N MET 175.A O no hydrogen 2.824 N/A ASN 137.A N THR 114.A O no hydrogen 2.855 N/A ASN 138.A N SER 174.A OG no hydrogen 3.009 N/A PHE 139.A N TYR 173.A O no hydrogen 2.820 N/A TYR 140.A N ALA 111.A O no hydrogen 2.885 N/A TYR 140.A OH GLU 105.A OE2 no hydrogen 3.108 N/A ASN 145.A N.A THR 197.A O no hydrogen 3.065 N/A ASN 145.A N.B THR 197.A O no hydrogen 3.094 N/A LYS 147.A N GLU 195.A O no hydrogen 2.857 N/A LYS 147.A NZ GLU 154.A OE2 no hydrogen 3.094 N/A TRP 148.A NE1 SER 177.A OG no hydrogen 2.836 N/A LYS 149.A N THR 193.A O no hydrogen 2.885 N/A LYS 149.A NZ GLU 195.A OE1 no hydrogen 3.019 N/A LYS 149.A NZ GLU 195.A OE2 no hydrogen 3.267 N/A ILE 150.A N SER 153.A O no hydrogen 2.835 N/A ASP 151.A N SER 191.A O no hydrogen 2.891 N/A SER 153.A N ILE 150.A O no hydrogen 2.931 N/A ARG 155.A N TRP 148.A O no hydrogen 2.976 N/A ARG 155.A NE ASN 157.A O no hydrogen 2.917 N/A ARG 155.A NH1 GLU 185.A OE2.A no hydrogen 3.134 N/A ARG 155.A NH2 GLU 185.A OE2.B no hydrogen 3.452 N/A LEU 160.A N THR 178.A O no hydrogen 2.776 N/A SER 162.A N SER 176.A O no hydrogen 2.885 N/A THR 164.A N SER 174.A O no hydrogen 2.998 N/A THR 164.A OG1 ASP 165.A O no hydrogen 3.482 N/A THR 164.A OG1 SER 174.A O no hydrogen 3.311 N/A GLN 166.A NE2 ILE 106.A O no hydrogen 2.814 N/A GLN 166.A NE2 SER 171.A O no hydrogen 2.891 N/A ASP 167.A N THR 172.A O no hydrogen 2.776 N/A LYS 169.A N ASP 167.A OD1 no hydrogen 2.918 N/A ASP 170.A N ASP 167.A OD1 no hydrogen 2.863 N/A SER 171.A N ASP 167.A O no hydrogen 3.028 N/A THR 172.A N ASP 170.A OD1 no hydrogen 2.970 N/A THR 172.A OG1 ASN 138.A OD1 no hydrogen 3.167 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 2.681 N/A TYR 173.A N PHE 139.A O no hydrogen 2.811 N/A TYR 173.A OH GLU 105.A OE1 no hydrogen 2.511 N/A SER 174.A N THR 164.A OG1 no hydrogen 2.972 N/A MET 175.A N LEU 136.A O no hydrogen 2.806 N/A SER 176.A N SER 162.A O no hydrogen 2.854 N/A SER 177.A N CYS 134.A O no hydrogen 3.042 N/A SER 177.A OG ASN 161.A OD1 no hydrogen 2.659 N/A THR 178.A N LEU 160.A O no hydrogen 2.833 N/A LEU 179.A N VAL 132.A O no hydrogen 2.794 N/A THR 180.A N GLY 158.A O no hydrogen 2.821 N/A THR 180.A OG1 SER 131.A OG no hydrogen 2.754 N/A LEU 181.A N ALA 130.A O no hydrogen 2.862 N/A THR 182.A N GLU 185.A OE1.B no hydrogen 2.688 N/A LYS 183.A N GLY 128.A O no hydrogen 3.037 N/A LYS 183.A NZ GLU 187.A OE1 no hydrogen 2.952 N/A LYS 183.A NZ GLU 187.A OE2 no hydrogen 2.837 N/A GLU 185.A N.A THR 182.A OG1 no hydrogen 3.087 N/A GLU 185.A N.B THR 182.A OG1 no hydrogen 3.091 N/A TYR 186.A N THR 182.A O no hydrogen 2.975 N/A GLU 187.A N LYS 183.A O no hydrogen 2.953 N/A ARG 188.A N GLU 185.A O.A no hydrogen 3.131 N/A ARG 188.A N GLU 185.A O.B no hydrogen 3.066 N/A HIS 189.A N TYR 186.A O no hydrogen 3.378 N/A HIS 189.A ND1 ASP 151.A OD2 no hydrogen 3.127 N/A ASN 190.A N ASP 151.A OD1 no hydrogen 2.887 N/A SER 191.A N ASP 151.A OD1 no hydrogen 3.040 N/A SER 191.A OG ASP 151.A OD1 no hydrogen 3.502 N/A TYR 192.A N PHE 209.A O no hydrogen 2.961 N/A TYR 192.A OH TYR 186.A O no hydrogen 2.601 N/A THR 193.A N LYS 149.A O no hydrogen 2.919 N/A THR 193.A OG1 SER 208.A OG.A no hydrogen 2.884 N/A THR 193.A OG1 SER 208.A OG.B no hydrogen 2.675 N/A CYS 194.A N.A LYS 207.A O no hydrogen 2.915 N/A CYS 194.A N.B LYS 207.A O no hydrogen 2.916 N/A CYS 194.A SG.B LYS 207.A O no hydrogen 3.740 N/A GLU 195.A N LYS 147.A O no hydrogen 2.870 N/A ALA 196.A N ILE 205.A O no hydrogen 2.746 N/A THR 197.A N ASN 145.A O.A no hydrogen 2.915 N/A THR 197.A N ASN 145.A O.B no hydrogen 2.812 N/A HIS 198.A ND1 THR 200.A OG1 no hydrogen 2.824 N/A HIS 198.A NE2 PRO 141.A O no hydrogen 2.907 N/A LYS 199.A NZ ASP 110.A OD2 no hydrogen 2.981 N/A THR 200.A N HIS 198.A ND1 no hydrogen 3.336 N/A THR 200.A OG1 HIS 198.A ND1 no hydrogen 2.824 N/A SER 201.A N HIS 198.A O no hydrogen 3.132 N/A SER 201.A OG SER 203.A O.A no hydrogen 2.813 N/A SER 201.A OG SER 203.A O.B no hydrogen 2.764 N/A SER 201.A OG SER 203.A OG.A no hydrogen 3.404 N/A SER 203.A N.A SER 201.A OG no hydrogen 3.304 N/A SER 203.A N.B SER 201.A OG no hydrogen 3.309 N/A SER 203.A OG.A SER 201.A OG no hydrogen 3.404 N/A ILE 205.A N ALA 196.A O no hydrogen 2.743 N/A LYS 207.A N CYS 194.A O.A no hydrogen 3.034 N/A LYS 207.A N CYS 194.A O.B no hydrogen 3.034 N/A SER 208.A OG.A THR 193.A OG1 no hydrogen 2.884 N/A SER 208.A OG.B TYR 192.A O no hydrogen 2.894 N/A SER 208.A OG.B THR 193.A OG1 no hydrogen 2.675 N/A PHE 209.A N TYR 192.A O no hydrogen 2.977 N/A ARG 211.A N ASN 190.A O no hydrogen 2.889 N/A ARG 211.A NH1 HIS 189.A O no hydrogen 2.865 N/A GLU 213.A N ASN 210.A O no hydrogen 3.100 N/A