Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4knv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 230.A O no hydrogen 2.908 N/A ARG 1.A NH2 ASP 230.A OD2 no hydrogen 2.671 N/A ALA 2.A N ASP 174.A O no hydrogen 3.137 N/A VAL 3.A N ARG 117.A O no hydrogen 2.975 N/A PHE 4.A N VAL 176.A O no hydrogen 2.706 N/A PHE 5.A N LEU 119.A O no hydrogen 2.704 N/A ASP 6.A N VAL 177.A O no hydrogen 2.930 N/A ASN 9.A N ILE 12.A O no hydrogen 2.791 N/A THR 10.A N LEU 7.A O no hydrogen 3.245 N/A THR 10.A OG1 ASP 6.A OD2 no hydrogen 2.564 N/A LEU 11.A N LEU 7.A O no hydrogen 2.919 N/A ILE 12.A N LEU 7.A O no hydrogen 3.434 N/A THR 14.A N ILE 12.A O no hydrogen 2.952 N/A THR 14.A OG1 ASP 8.A OD1 no hydrogen 2.512 N/A ALA 15.A N ASN 9.A OD1 no hydrogen 2.973 N/A GLY 16.A N ASP 13.A OD1 no hydrogen 2.934 N/A ALA 17.A N ASP 13.A O no hydrogen 2.967 N/A SER 18.A N THR 14.A O no hydrogen 2.892 N/A SER 18.A OG THR 14.A O no hydrogen 3.324 N/A ARG 19.A N ALA 15.A O no hydrogen 2.884 N/A ARG 20.A N GLY 16.A O no hydrogen 2.825 N/A ARG 20.A NH1 GLU 23.A OE2 no hydrogen 3.166 N/A GLY 21.A N ALA 17.A O no hydrogen 2.984 N/A GLU 23.A N ARG 20.A O no hydrogen 2.997 N/A VAL 24.A N GLY 21.A O no hydrogen 3.038 N/A LYS 26.A N LEU 22.A O no hydrogen 3.083 N/A LEU 27.A N GLU 23.A O no hydrogen 2.922 N/A LEU 28.A N VAL 24.A O no hydrogen 2.851 N/A GLN 29.A N ILE 25.A O no hydrogen 2.867 N/A GLN 29.A NE2 LYS 35.A O no hydrogen 2.790 N/A SER 30.A N LYS 26.A O no hydrogen 2.765 N/A SER 30.A OG LYS 26.A O no hydrogen 3.230 N/A LYS 31.A N LEU 27.A O no hydrogen 2.797 N/A LYS 31.A NZ TYR 32.A OH no hydrogen 3.274 N/A LYS 31.A NZ GLU 88.A OE2 no hydrogen 2.688 N/A TYR 32.A N LEU 28.A O no hydrogen 3.208 N/A TYR 32.A OH GLU 88.A OE1 no hydrogen 2.542 N/A TYR 32.A OH GLU 88.A OE2 no hydrogen 3.329 N/A TYR 34.A N LEU 28.A O no hydrogen 2.994 N/A LYS 35.A N GLU 37.A OE1 no hydrogen 2.738 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.820 N/A ALA 38.A N LYS 35.A O no hydrogen 3.222 N/A ILE 40.A N GLU 36.A O no hydrogen 3.256 N/A ILE 41.A N GLU 37.A O no hydrogen 2.898 N/A CYS 42.A N ALA 38.A O no hydrogen 3.110 N/A CYS 42.A SG ALA 38.A O no hydrogen 3.497 N/A ASP 43.A N GLU 39.A O no hydrogen 2.834 N/A LYS 44.A N ILE 40.A O no hydrogen 3.045 N/A VAL 45.A N ILE 41.A O no hydrogen 3.021 N/A GLN 46.A N CYS 42.A O no hydrogen 3.019 N/A VAL 47.A N ASP 43.A O no hydrogen 3.080 N/A LYS 48.A N LYS 44.A O no hydrogen 2.959 N/A LYS 48.A NZ GLU 71.A OE1 no hydrogen 2.863 N/A LYS 48.A NZ GLU 75.A OE1 no hydrogen 3.369 N/A LYS 48.A NZ GLU 75.A OE2 no hydrogen 2.992 N/A LEU 49.A N VAL 45.A O no hydrogen 2.736 N/A SER 50.A N GLN 46.A O no hydrogen 2.964 N/A SER 50.A OG VAL 47.A O no hydrogen 2.614 N/A LYS 51.A N VAL 47.A O no hydrogen 3.047 N/A LYS 51.A N LYS 48.A O no hydrogen 3.051 N/A GLU 52.A N LEU 49.A O no hydrogen 3.274 N/A ASN 58.A N HIS 55.A O no hydrogen 2.800 N/A LEU 64.A N CYS 60.A O no hydrogen 3.140 N/A ARG 65.A N ILE 61.A O no hydrogen 2.943 N/A ARG 65.A NE GLU 52.A OE1 no hydrogen 2.978 N/A ARG 65.A NH2 GLU 52.A OE2 no hydrogen 3.174 N/A THR 66.A N THR 62.A O no hydrogen 3.032 N/A THR 66.A OG1 THR 62.A O no hydrogen 2.781 N/A SER 67.A N ASP 63.A O no hydrogen 2.900 N/A SER 67.A OG ASP 63.A O no hydrogen 3.118 N/A HIS 68.A N LEU 64.A O no hydrogen 3.152 N/A TRP 69.A N ARG 65.A O no hydrogen 3.380 N/A GLU 70.A N THR 66.A O no hydrogen 3.011 N/A GLU 71.A N SER 67.A O no hydrogen 2.926 N/A ALA 72.A N HIS 68.A O no hydrogen 2.938 N/A ILE 73.A N TRP 69.A O no hydrogen 2.863 N/A GLN 74.A N GLU 70.A O no hydrogen 3.084 N/A GLN 74.A NE2 GLY 79.A O no hydrogen 3.061 N/A GLU 75.A N GLU 71.A O no hydrogen 2.660 N/A THR 76.A N ALA 72.A O no hydrogen 3.143 N/A THR 76.A N ILE 73.A O no hydrogen 3.238 N/A THR 76.A OG1 ALA 72.A O no hydrogen 2.879 N/A LYS 77.A N ILE 73.A O no hydrogen 2.778 N/A LYS 77.A NZ GLU 37.A OE2 no hydrogen 3.003 N/A GLY 78.A N GLN 74.A O no hydrogen 2.809 N/A ARG 83.A NH1 SER 67.A OG no hydrogen 2.669 N/A ARG 83.A NH1 GLU 70.A OE1 no hydrogen 2.934 N/A ARG 83.A NH2 ASP 63.A O no hydrogen 3.161 N/A LEU 85.A N ASN 82.A OD1 no hydrogen 3.136 N/A ALA 86.A N ASN 82.A O no hydrogen 3.058 N/A GLU 87.A N ARG 83.A O no hydrogen 2.880 N/A GLU 88.A N LYS 84.A O no hydrogen 3.001 N/A CYS 89.A N LEU 85.A O no hydrogen 2.979 N/A CYS 89.A SG LEU 85.A O no hydrogen 3.414 N/A TYR 90.A N ALA 86.A O no hydrogen 2.899 N/A PHE 91.A N GLU 87.A O no hydrogen 2.997 N/A LEU 92.A N GLU 88.A O no hydrogen 3.276 N/A TRP 93.A N CYS 89.A O no hydrogen 2.885 N/A LYS 94.A N TYR 90.A O no hydrogen 2.788 N/A LYS 94.A NZ GLU 131.A OE2 no hydrogen 2.688 N/A SER 95.A N PHE 91.A O no hydrogen 3.024 N/A SER 95.A OG PHE 91.A O no hydrogen 2.880 N/A SER 95.A OG LEU 92.A O no hydrogen 3.339 N/A THR 96.A N LEU 92.A O no hydrogen 2.969 N/A THR 96.A OG1 LEU 92.A O no hydrogen 2.774 N/A ARG 97.A N TRP 93.A O no hydrogen 3.020 N/A ARG 97.A NE SER 18.A OG no hydrogen 3.180 N/A ARG 97.A NH2 SER 18.A OG no hydrogen 2.746 N/A LEU 98.A N LYS 94.A O no hydrogen 3.021 N/A GLN 99.A N SER 95.A O no hydrogen 2.997 N/A HIS 100.A N THR 96.A O no hydrogen 3.108 N/A LYS 107.A N ALA 103.A O no hydrogen 2.878 N/A ALA 108.A N GLU 104.A O no hydrogen 2.913 N/A THR 110.A N LYS 107.A O no hydrogen 2.940 N/A THR 110.A OG1 LYS 107.A O no hydrogen 2.991 N/A GLU 111.A N ALA 108.A O no hydrogen 2.915 N/A ARG 113.A N LEU 109.A O no hydrogen 3.119 N/A ARG 113.A NE ASP 143.A OD1 no hydrogen 3.255 N/A ARG 113.A NH2 ASP 143.A OD1 no hydrogen 2.829 N/A LYS 114.A N GLU 111.A O no hydrogen 3.327 N/A LYS 114.A NZ GLU 111.A OE1.B no hydrogen 3.512 N/A GLU 115.A N LEU 112.A O no hydrogen 2.989 N/A VAL 116.A N LEU 112.A O no hydrogen 3.039 N/A ARG 117.A N ARG 1.A O no hydrogen 3.111 N/A ARG 117.A NH1 LEU 168.A O no hydrogen 2.793 N/A LEU 118.A N ASP 143.A OD2 no hydrogen 2.941 N/A LEU 119.A N VAL 3.A O no hydrogen 3.078 N/A LEU 120.A N ALA 144.A O no hydrogen 2.959 N/A LEU 121.A N PHE 5.A O no hydrogen 2.793 N/A THR 122.A N VAL 146.A O no hydrogen 3.003 N/A THR 122.A OG1 ASN 123.A O no hydrogen 3.371 N/A ASN 123.A ND2 LYS 155.A O no hydrogen 2.972 N/A GLY 124.A N GLU 154.A OE2 no hydrogen 2.577 N/A GLN 127.A NE2 GLU 131.A OE2 no hydrogen 3.085 N/A THR 128.A N ASP 125.A OD2 no hydrogen 2.883 N/A THR 128.A OG1 ASP 125.A OD1 no hydrogen 2.946 N/A THR 128.A OG1 ASP 125.A OD2 no hydrogen 3.034 N/A GLN 129.A N ASP 125.A O no hydrogen 3.006 N/A GLN 129.A NE2 ASP 8.A OD2 no hydrogen 3.096 N/A GLN 129.A NE2 THR 122.A OG1 no hydrogen 2.749 N/A ARG 130.A N ARG 126.A O no hydrogen 2.892 N/A ARG 130.A NE GLU 150.A OE2 no hydrogen 2.777 N/A ARG 130.A NH2 GLU 150.A OE1 no hydrogen 3.024 N/A GLU 131.A N GLN 127.A O no hydrogen 2.944 N/A LYS 132.A N THR 128.A O no hydrogen 3.036 N/A LYS 132.A NZ ASP 8.A OD1 no hydrogen 3.003 N/A LYS 132.A NZ ASP 8.A OD2 no hydrogen 3.214 N/A LYS 132.A NZ GLN 129.A OE1 no hydrogen 2.945 N/A ILE 133.A N GLN 129.A O no hydrogen 2.852 N/A GLU 134.A N ARG 130.A O no hydrogen 2.912 N/A ALA 135.A N GLU 131.A O no hydrogen 2.927 N/A CYS 136.A N LYS 132.A O no hydrogen 3.052 N/A CYS 136.A SG LYS 132.A O no hydrogen 3.393 N/A CYS 136.A SG ILE 133.A O no hydrogen 4.004 N/A ALA 137.A N GLU 134.A O no hydrogen 3.302 N/A CYS 138.A N ILE 133.A O no hydrogen 3.408 N/A CYS 138.A SG ILE 133.A O no hydrogen 4.045 N/A TYR 141.A N CYS 138.A O no hydrogen 2.931 N/A PHE 142.A N GLN 139.A O no hydrogen 3.342 N/A ASP 143.A N LEU 118.A O no hydrogen 2.737 N/A ALA 144.A N LEU 118.A O no hydrogen 3.441 N/A VAL 146.A N LEU 120.A O no hydrogen 2.757 N/A GLY 148.A N THR 122.A O no hydrogen 2.721 N/A GLY 149.A N GLY 124.A O no hydrogen 2.999 N/A GLU 150.A N VAL 147.A O no hydrogen 2.930 N/A GLN 151.A N GLY 148.A O no hydrogen 2.847 N/A LYS 155.A N ASN 123.A OD1 no hydrogen 3.027 N/A LYS 155.A NZ ASP 6.A OD1 no hydrogen 2.943 N/A LYS 155.A NZ LEU 121.A O no hydrogen 2.798 N/A LYS 155.A NZ ASP 184.A OD1 no hydrogen 2.757 N/A ALA 157.A N GLU 154.A O no hydrogen 2.826 N/A SER 159.A OG GLU 153.A OE1 no hydrogen 2.701 N/A TYR 162.A N PRO 158.A O no hydrogen 2.976 N/A TYR 163.A N SER 159.A O no hydrogen 2.961 N/A CYS 164.A N ILE 160.A O no hydrogen 2.980 N/A CYS 164.A SG ILE 160.A O no hydrogen 3.319 N/A CYS 165.A N PHE 161.A O no hydrogen 2.856 N/A CYS 165.A SG PHE 161.A O no hydrogen 3.329 N/A ASN 166.A N TYR 162.A O no hydrogen 2.926 N/A LEU 167.A N TYR 163.A O no hydrogen 2.834 N/A LEU 168.A N CYS 164.A O no hydrogen 3.115 N/A GLY 169.A N ASN 166.A O no hydrogen 2.886 N/A VAL 170.A N CYS 165.A O no hydrogen 2.869 N/A GLN 171.A N ASP 174.A OD2 no hydrogen 2.952 N/A ASP 174.A N GLN 171.A O no hydrogen 2.902 N/A CYS 175.A N PRO 172.A O no hydrogen 3.075 N/A CYS 175.A SG GLN 171.A O no hydrogen 3.321 N/A VAL 176.A N ALA 2.A O no hydrogen 3.044 N/A GLY 178.A N VAL 197.A O no hydrogen 3.064 N/A THR 180.A N ASP 184.A OD2 no hydrogen 3.168 N/A THR 180.A OG1 ASP 179.A OD1 no hydrogen 3.247 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.888 N/A ASP 184.A N THR 180.A O no hydrogen 2.932 N/A ILE 185.A N THR 180.A O no hydrogen 3.283 N/A GLN 186.A N LEU 181.A O no hydrogen 2.886 N/A GLN 186.A NE2 ASN 190.A OD1 no hydrogen 2.698 N/A GLY 187.A N THR 183.A O no hydrogen 3.098 N/A GLY 188.A N ASP 184.A O no hydrogen 3.038 N/A LEU 189.A N ILE 185.A O no hydrogen 2.900 N/A ASN 190.A N GLN 186.A O no hydrogen 2.753 N/A ASN 190.A ND2 PRO 156.A O no hydrogen 2.908 N/A ALA 191.A N GLY 187.A O no hydrogen 2.922 N/A GLY 192.A N LEU 189.A O no hydrogen 3.215 N/A LEU 193.A N GLY 188.A O no hydrogen 3.028 N/A LYS 194.A N PRO 172.A O no hydrogen 3.174 N/A ALA 195.A N CYS 175.A O no hydrogen 3.409 N/A THR 196.A N HIS 214.A ND1 no hydrogen 3.092 N/A THR 196.A OG1 HIS 214.A ND1 no hydrogen 3.027 N/A TRP 198.A N TYR 215.A O no hydrogen 2.836 N/A TRP 198.A NE1 ASP 179.A O no hydrogen 3.017 N/A ILE 199.A N GLY 178.A O no hydrogen 2.914 N/A ASN 200.A N VAL 216.A O no hydrogen 2.829 N/A ASN 200.A ND2 ILE 204.A O no hydrogen 2.795 N/A LYS 201.A NZ SER 217.A O no hydrogen 3.022 N/A GLY 203.A N ASN 200.A O no hydrogen 3.288 N/A ILE 204.A N ASN 200.A OD1 no hydrogen 3.150 N/A SER 209.A OG LYS 208.A O no hydrogen 2.406 N/A SER 210.A N LEU 207.A O no hydrogen 3.056 N/A SER 210.A OG.B LEU 207.A O no hydrogen 2.780 N/A HIS 214.A N THR 196.A OG1 no hydrogen 3.091 N/A HIS 214.A ND1 THR 196.A OG1 no hydrogen 3.027 N/A TYR 215.A N THR 196.A O no hydrogen 2.964 N/A SER 217.A N GLU 221.A OE2 no hydrogen 2.655 N/A SER 217.A OG GLU 221.A OE2 no hydrogen 2.693 N/A SER 218.A N GLU 221.A OE2 no hydrogen 2.745 N/A LEU 220.A N SER 218.A OG no hydrogen 2.921 N/A GLU 221.A N SER 218.A O no hydrogen 2.939 N/A LEU 222.A N VAL 219.A O no hydrogen 3.107 N/A LEU 225.A N GLU 221.A O no hydrogen 3.286 N/A LEU 226.A N LEU 222.A O no hydrogen 2.707 N/A GLN 227.A N PRO 223.A O no hydrogen 2.799 N/A SER 228.A N LEU 225.A O no hydrogen 2.906 N/A SER 228.A OG LEU 225.A O no hydrogen 2.902 N/A ILE 229.A N LEU 225.A O no hydrogen 3.108 N/A CYS 231.A N ILE 229.A O no hydrogen 2.872 N/A LEU 232.A N LEU 226.A O no hydrogen 2.931 N/A VAL 233.A N GLU 115.A OE1 no hydrogen 2.926 N/A